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Acta Crystallogr Sect E Struct Rep Online. 2008 February 1; 64(Pt 2): m395.
Published online 2008 January 23. doi:  10.1107/S1600536808002031
PMCID: PMC2960176

(2-Amino-5-chloro­benzene­sulfonato)bis­(triphenyl­phosphine)silver(I)

Abstract

The asymmetric unit of the title mononuclear compound, [Ag(C6H5ClNO3S)(C18H15P)2], contains four independent mol­ecules. In each of the mol­ecules, the AgI cation is three-coordinated by two triphenyl­phosphine ligands, and one N atom from a 2-amino-5-chloro­benzene­sulfonate anion. The mol­ecules are linked into a one-dimensional supra­molecular structure by N—H(...)O hydrogen bonds.

Related literature

For a related structure, see: Dong et al. (2007 [triangle]).

An external file that holds a picture, illustration, etc.
Object name is e-64-0m395-scheme1.jpg

Experimental

Crystal data

  • [Ag(C6H5ClNO3S)(C18H15P)2]
  • M r = 839.03
  • Triclinic, An external file that holds a picture, illustration, etc.
Object name is e-64-0m395-efi1.jpg
  • a = 15.403 (5) Å
  • b = 23.1750 (19) Å
  • c = 23.3300 (16) Å
  • α = 100.771 (4)°
  • β = 104.852 (6)°
  • γ = 97.035 (4)°
  • V = 7780 (3) Å3
  • Z = 8
  • Mo Kα radiation
  • μ = 0.76 mm−1
  • T = 293 (2) K
  • 0.32 × 0.28 × 0.23 mm

Data collection

  • Rigaku R-AXIS RAPID diffractometer
  • Absorption correction: multi-scan (ABSCOR; Higashi, 1995 [triangle]) T min = 0.788, T max = 0.841
  • 35542 measured reflections
  • 31947 independent reflections
  • 19413 reflections with I > 2σ(I)
  • R int = 0.007

Refinement

  • R[F 2 > 2σ(F 2)] = 0.063
  • wR(F 2) = 0.138
  • S = 0.78
  • 31947 reflections
  • 1861 parameters
  • 9 restraints
  • H atoms treated by a mixture of independent and constrained refinement
  • Δρmax = 0.70 e Å−3
  • Δρmin = −0.63 e Å−3

Data collection: PROCESS-AUTO (Rigaku, 1998 [triangle]); cell refinement: PROCESS-AUTO; data reduction: PROCESS-AUTO; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 [triangle]); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 [triangle]); molecular graphics: SHELXTL-Plus (Sheldrick, 2008 [triangle]); software used to prepare material for publication: SHELXL97.

Table 1
Selected geometric parameters (Å, °)
Table 2
Hydrogen-bond geometry (Å, °)

Supplementary Material

Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536808002031/ci2554sup1.cif

Structure factors: contains datablocks I. DOI: 10.1107/S1600536808002031/ci2554Isup2.hkl

Additional supplementary materials: crystallographic information; 3D view; checkCIF report

Acknowledgments

We thank the Science Foundation for Young Teachers of Northeast Normal University (grant No. 20070314) for support.

supplementary crystallographic information

Comment

The asymmetric unit of the title compound contains four independent molecules (Fig. 1). In each of the molecules, the metal atom is three-coordinated by one 2-amino-5-chlorobenzenesulfonate (L) anion and two triphenylphosphine ligands (Table 1). The Ag—P distances are comparable to those observed in a related structure (Dong et al., 2007). Here, the coordination ability of the amino group of L is evidently stronger than that of sulfonate group and the latter group does not coordinate to the Ag ion.

In the crystal structure of the title compound, adjacent molecules are interconnected by strong N—H···O hydrogen bonds (Table 2) to form a one-dimensional supramolecular structure (Fig. 2).

Experimental

An aqueous solution (10 ml) of 2-amino-5-chlorobenzenesulfonic acid (0.104 g, 0.5 mmol) was added to solid Ag2CO3 (0.069 g, 0.25 mmol) and stirred for several minutes until no further CO2 was given off; triphenylphosphine (0.226 g, 1.0 mmol) in acetonitrile (10 ml) was then added and a white precipitate formed. The precipitate was dissolved by dropwise addition of an aqueous solution of NH3 (14 M). Colourless blocks of the title compound were obtained by evaporation of the solution for several days at room temperature.

Refinement

The H atoms of the amino group were located in a difference map and refined with a N—H distance restraint of 0.85 Å, and with Uiso(H) = 1.2Ueq(N). The bond distance restraint was also used in the refinement of hn2a and hn2b. C-bound H-atoms were geometrically positioned (C—H = 0.93 Å) and refined using a riding model, with Uiso(H) = 1.2Ueq(C).

Figures

Fig. 1.
The asymmetric unit of the title compound. Displacement ellipsoids are drawn at the 30% probability level. All C-atom labels have been omitted for clarity.
Fig. 2.
One-dimensional supramolecular structure of the title compound, formed through hydrogen-bonding (dashed lines) interactions. The H atoms not involved in hydrogen bonding interactions have been omitted.

Crystal data

[Ag(C6H5ClNO3S)(C18H15P)2]Z = 8
Mr = 839.03F000 = 3424
Triclinic, P1Dx = 1.433 Mg m3
Hall symbol: -P 1Mo Kα radiation λ = 0.71069 Å
a = 15.403 (5) ÅCell parameters from 9413 reflections
b = 23.1750 (19) Åθ = 1.4–27.5º
c = 23.3300 (16) ŵ = 0.76 mm1
α = 100.771 (4)ºT = 293 (2) K
β = 104.852 (6)ºBlock, colourless
γ = 97.035 (4)º0.32 × 0.28 × 0.23 mm
V = 7780 (3) Å3

Data collection

Rigaku R-AXIS RAPID diffractometer31947 independent reflections
Radiation source: fine-focus sealed tube19413 reflections with I > 2σ(I)
Monochromator: graphiteRint = 0.007
T = 293(2) Kθmax = 27.5º
ω scanθmin = 1.4º
Absorption correction: multi-scan(ABSCOR; Higashi, 1995)h = −19→19
Tmin = 0.788, Tmax = 0.841k = −29→29
35542 measured reflectionsl = −30→28

Refinement

Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.063H atoms treated by a mixture of independent and constrained refinement
wR(F2) = 0.138  w = 1/[σ2(Fo2) + (0.0406P)2] where P = (Fo2 + 2Fc2)/3
S = 0.78(Δ/σ)max = 0.009
31947 reflectionsΔρmax = 0.70 e Å3
1861 parametersΔρmin = −0.63 e Å3
9 restraintsExtinction correction: none
Primary atom site location: structure-invariant direct methods

Special details

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2)

xyzUiso*/Ueq
Ag10.02749 (4)0.17954 (3)0.88118 (3)0.0747 (2)
Ag20.53367 (4)0.16690 (2)0.38665 (3)0.0652 (2)
Ag30.47835 (4)0.32170 (2)0.13062 (3)0.06427 (19)
Ag40.01434 (4)0.66717 (2)0.37251 (3)0.0707 (2)
C10.1074 (5)0.0409 (3)0.8513 (4)0.057 (2)
C20.1397 (6)0.0032 (3)0.8129 (4)0.077 (2)
H20.1072−0.00800.77180.093*
C30.2188 (6)−0.0193 (4)0.8322 (5)0.096 (3)
H30.2406−0.04410.80500.115*
C40.2642 (7)−0.0030 (5)0.8945 (6)0.103 (3)
H40.3160−0.01870.90920.123*
C50.2352 (6)0.0350 (5)0.9341 (5)0.101 (3)
H50.26750.04610.97520.121*
C60.1575 (6)0.0568 (3)0.9127 (4)0.077 (2)
H60.13750.08300.93980.092*
C7−0.0341 (5)0.0544 (3)0.7496 (3)0.0550 (19)
C8−0.0726 (5)−0.0046 (3)0.7181 (4)0.071 (2)
H8−0.0740−0.03480.73930.086*
C9−0.1085 (5)−0.0178 (4)0.6553 (4)0.079 (2)
H9−0.1341−0.05710.63490.095*
C10−0.1074 (6)0.0238 (5)0.6237 (4)0.099 (3)
H10−0.12980.01360.58140.118*
C11−0.0731 (6)0.0816 (5)0.6535 (5)0.088 (3)
H11−0.07500.11120.63140.106*
C12−0.0355 (5)0.0972 (3)0.7158 (4)0.065 (2)
H12−0.01090.13690.73510.078*
C13−0.0804 (5)0.0280 (3)0.8532 (3)0.0519 (19)
C14−0.0598 (5)−0.0123 (3)0.8893 (3)0.069 (2)
H140.0000−0.01830.90240.083*
C15−0.1294 (6)−0.0444 (3)0.9063 (4)0.079 (3)
H15−0.1157−0.07280.92910.095*
C16−0.2153 (6)−0.0342 (4)0.8898 (4)0.083 (3)
H16−0.2602−0.05320.90350.100*
C17−0.2367 (5)0.0049 (3)0.8520 (4)0.072 (2)
H17−0.29690.01000.83830.087*
C18−0.1694 (5)0.0365 (3)0.8344 (3)0.065 (2)
H18−0.18430.06330.80990.078*
C19−0.2013 (5)0.1922 (3)0.8681 (4)0.0519 (19)
C20−0.2105 (6)0.1907 (3)0.8080 (4)0.071 (2)
H20−0.15870.20050.79590.086*
C21−0.2926 (9)0.1754 (4)0.7658 (5)0.098 (3)
H21−0.29650.17460.72530.117*
C22−0.3709 (8)0.1608 (4)0.7821 (6)0.103 (4)
H22−0.42760.15220.75300.124*
C23−0.3648 (6)0.1592 (4)0.8405 (5)0.092 (3)
H23−0.41700.14680.85130.111*
C24−0.2808 (5)0.1758 (3)0.8845 (4)0.070 (2)
H24−0.27720.17600.92500.085*
C25−0.0853 (6)0.2976 (3)0.9422 (4)0.065 (2)
C26−0.1587 (7)0.3250 (4)0.9206 (4)0.086 (3)
H26−0.21360.30130.89610.103*
C27−0.1522 (9)0.3869 (4)0.9347 (5)0.120 (4)
H27−0.20070.40460.91780.144*
C28−0.0728 (10)0.4211 (5)0.9738 (6)0.129 (5)
H28−0.06880.46210.98620.155*
C290.0001 (8)0.3955 (5)0.9946 (6)0.134 (5)
H290.05470.41981.01890.161*
C30−0.0046 (6)0.3331 (4)0.9802 (5)0.111 (4)
H300.04540.31610.99590.133*
C31−0.0988 (4)0.1921 (3)0.9889 (3)0.0488 (18)
C32−0.1052 (5)0.2275 (3)1.0407 (3)0.063 (2)
H32−0.10760.26771.04230.075*
C33−0.1081 (5)0.2044 (4)1.0913 (4)0.079 (2)
H33−0.11150.22881.12690.095*
C34−0.1059 (6)0.1454 (4)1.0877 (4)0.086 (3)
H34−0.10960.12971.12110.103*
C35−0.0987 (5)0.1088 (4)1.0379 (4)0.081 (3)
H35−0.09630.06871.03700.097*
C36−0.0950 (5)0.1320 (3)0.9881 (4)0.076 (2)
H36−0.08990.10720.95330.091*
C370.2453 (5)0.2269 (4)0.7688 (4)0.078 (3)
H370.23410.24040.73290.093*
C380.1997 (4)0.2441 (3)0.8106 (3)0.0457 (18)
C390.2173 (5)0.2261 (3)0.8651 (4)0.059 (2)
C400.2816 (5)0.1885 (4)0.8761 (4)0.073 (2)
H400.29360.17500.91200.088*
C410.3267 (5)0.1717 (4)0.8337 (5)0.092 (3)
H410.37050.14770.84170.110*
C420.3080 (6)0.1895 (4)0.7800 (4)0.086 (3)
C430.4745 (5)0.0098 (3)0.3501 (3)0.0536 (19)
C440.3819 (5)0.0043 (3)0.3189 (3)0.063 (2)
H440.36410.02720.29060.075*
C450.3173 (5)−0.0354 (4)0.3305 (4)0.077 (3)
H450.2559−0.03900.30990.092*
C460.3429 (6)−0.0691 (4)0.3717 (4)0.083 (3)
H460.2993−0.09550.37960.100*
C470.4332 (7)−0.0636 (4)0.4013 (4)0.096 (3)
H470.4507−0.08640.42970.115*
C480.4995 (5)−0.0247 (4)0.3899 (4)0.082 (3)
H480.5609−0.02240.40970.098*
C490.6656 (5)0.0505 (3)0.3669 (4)0.060 (2)
C500.7128 (7)0.0741 (3)0.4264 (5)0.083 (3)
H500.68550.09650.45180.099*
C510.8018 (9)0.0650 (4)0.4496 (5)0.107 (4)
H510.83380.08140.49020.128*
C520.8409 (8)0.0322 (6)0.4124 (7)0.123 (6)
H520.90000.02600.42790.148*
C530.7967 (7)0.0085 (5)0.3542 (6)0.105 (4)
H530.8248−0.01420.32950.126*
C540.7083 (6)0.0177 (4)0.3300 (4)0.085 (3)
H540.67790.00170.28910.101*
C550.5330 (4)0.0572 (3)0.2574 (3)0.0483 (18)
C560.5048 (5)0.0006 (3)0.2176 (4)0.078 (2)
H560.4946−0.03330.23260.093*
C570.4923 (6)−0.0044 (4)0.1566 (5)0.107 (3)
H570.4738−0.04180.13020.128*
C580.5065 (7)0.0443 (5)0.1345 (5)0.115 (4)
H580.49930.03990.09300.138*
C590.5309 (8)0.0990 (5)0.1710 (5)0.118 (4)
H590.53840.13230.15460.142*
C600.5446 (5)0.1059 (3)0.2317 (4)0.080 (3)
H600.56220.14410.25670.096*
C610.3678 (4)0.1595 (3)0.4684 (3)0.0481 (18)
C620.3515 (6)0.1870 (3)0.5202 (4)0.093 (3)
H620.35800.22840.52970.112*
C630.3256 (6)0.1553 (4)0.5590 (4)0.111 (4)
H630.31500.17540.59430.133*
C640.3153 (5)0.0945 (4)0.5465 (4)0.077 (3)
H640.29820.07300.57300.092*
C650.3304 (6)0.0664 (4)0.4951 (4)0.082 (3)
H650.32270.02490.48560.098*
C660.3573 (5)0.0982 (3)0.4558 (3)0.073 (2)
H660.36830.07790.42070.087*
C670.2972 (5)0.1823 (3)0.3502 (4)0.057 (2)
C680.3015 (6)0.1682 (3)0.2914 (4)0.073 (2)
H680.35810.16630.28470.088*
C690.2246 (8)0.1565 (4)0.2414 (4)0.101 (4)
H690.22850.14580.20180.121*
C700.1430 (8)0.1614 (5)0.2533 (6)0.120 (5)
H700.09040.15430.22080.144*
C710.1360 (7)0.1764 (4)0.3112 (6)0.104 (4)
H710.07950.17980.31750.125*
C720.2120 (6)0.1865 (3)0.3599 (4)0.081 (3)
H720.20720.19620.39940.098*
C730.4179 (5)0.2762 (3)0.4476 (3)0.0490 (19)
C740.4882 (5)0.2995 (4)0.4981 (4)0.071 (2)
H740.52500.27450.51510.085*
C750.5071 (6)0.3608 (4)0.5257 (4)0.089 (3)
H750.55600.37560.56060.107*
C760.4549 (8)0.3987 (5)0.5023 (6)0.110 (4)
H760.46550.43900.52120.132*
C770.3874 (7)0.3754 (4)0.4506 (5)0.099 (3)
H770.35200.40090.43320.119*
C780.3678 (5)0.3157 (4)0.4220 (4)0.080 (3)
H780.32120.30200.38570.096*
C790.7131 (4)0.2350 (3)0.3754 (3)0.0443 (17)
C800.7834 (4)0.2030 (3)0.3885 (3)0.0498 (19)
H800.79750.19090.42510.060*
C810.8327 (5)0.1889 (3)0.3476 (4)0.068 (2)
H810.88040.16800.35660.082*
C820.8092 (5)0.2066 (3)0.2930 (4)0.070 (2)
C830.7420 (5)0.2393 (3)0.2791 (3)0.059 (2)
H830.72950.25230.24300.071*
C840.6928 (4)0.2525 (3)0.3208 (3)0.0465 (18)
C850.4347 (5)0.4502 (3)0.2326 (4)0.056 (2)
C860.3700 (5)0.4869 (3)0.2389 (4)0.076 (2)
H860.33830.49980.20550.092*
C870.3530 (6)0.5040 (4)0.2947 (6)0.098 (3)
H870.31070.52880.29840.118*
C880.3976 (7)0.4848 (4)0.3438 (5)0.102 (3)
H880.38390.49490.38060.122*
C890.4624 (6)0.4506 (4)0.3389 (4)0.077 (3)
H890.49510.43910.37300.093*
C900.4800 (5)0.4329 (3)0.2834 (4)0.072 (2)
H900.52340.40880.28060.086*
C910.3815 (5)0.4462 (3)0.1036 (3)0.058 (2)
C920.3918 (6)0.5015 (4)0.0889 (4)0.096 (3)
H920.44190.53070.11160.115*
C930.3294 (8)0.5133 (5)0.0415 (5)0.136 (5)
H930.33540.55130.03370.163*
C940.2585 (9)0.4702 (7)0.0053 (6)0.146 (5)
H940.21860.4774−0.02880.175*
C950.2475 (7)0.4175 (6)0.0199 (6)0.135 (5)
H950.19760.3886−0.00380.162*
C960.3072 (6)0.4041 (4)0.0688 (5)0.097 (3)
H960.29700.36700.07800.116*
C970.5682 (5)0.4789 (3)0.1731 (4)0.056 (2)
C980.6214 (6)0.4649 (3)0.1363 (4)0.093 (3)
H980.60510.42840.10820.111*
C990.7002 (6)0.5039 (4)0.1395 (5)0.121 (4)
H990.73370.49490.11210.145*
C1000.7270 (5)0.5557 (4)0.1840 (5)0.085 (3)
H1000.78160.58070.18860.102*
C1010.6762 (6)0.5708 (4)0.2208 (4)0.087 (3)
H1010.69340.60720.24920.105*
C1020.5950 (5)0.5309 (4)0.2163 (4)0.078 (2)
H1020.56050.54050.24300.093*
C1030.5231 (4)0.3070 (3)−0.0165 (3)0.0504 (19)
C1040.5561 (5)0.2855 (3)−0.0643 (4)0.073 (2)
H1040.60080.2618−0.05850.088*
C1050.5250 (7)0.2979 (4)−0.1197 (4)0.092 (3)
H1050.54640.2812−0.15170.110*
C1060.4623 (8)0.3348 (5)−0.1289 (5)0.119 (4)
H1060.44390.3454−0.16610.142*
C1070.4267 (7)0.3562 (4)−0.0818 (5)0.100 (3)
H1070.38140.3794−0.08800.121*
C1080.4583 (5)0.3432 (4)−0.0262 (4)0.082 (3)
H1080.43590.35900.00560.099*
C1090.6809 (4)0.3247 (3)0.0879 (3)0.0485 (18)
C1100.7216 (5)0.3252 (3)0.1491 (4)0.069 (2)
H1100.68780.30750.17110.082*
C1110.8111 (6)0.3515 (3)0.1767 (4)0.085 (3)
H1110.83810.35080.21700.101*
C1120.8611 (5)0.3790 (3)0.1451 (5)0.073 (3)
H1120.92110.39820.16430.088*
C1130.8225 (6)0.3780 (3)0.0866 (4)0.070 (2)
H1130.85750.39420.06440.085*
C1140.7326 (5)0.3534 (3)0.0587 (3)0.062 (2)
H1140.70620.35630.01900.074*
C1150.5647 (4)0.2099 (3)0.0372 (3)0.0425 (17)
C1160.4843 (5)0.1713 (4)0.0175 (4)0.070 (2)
H1160.43020.18530.01700.084*
C1170.4827 (6)0.1114 (4)−0.0018 (4)0.096 (3)
H1170.42670.0855−0.01760.115*
C1180.5629 (7)0.0883 (4)0.0017 (4)0.083 (3)
H1180.56130.0475−0.01020.099*
C1190.6426 (6)0.1271 (4)0.0228 (4)0.085 (3)
H1190.69730.11310.02580.102*
C1200.6435 (5)0.1880 (3)0.0403 (4)0.068 (2)
H1200.69910.21420.05450.082*
C1210.3203 (5)0.2645 (3)0.1752 (3)0.0460 (18)
C1220.2394 (5)0.2484 (3)0.1295 (3)0.0488 (19)
C1230.1588 (5)0.2661 (3)0.1403 (4)0.062 (2)
H1230.10370.25590.10960.074*
C1240.1641 (5)0.2985 (3)0.1970 (4)0.060 (2)
C1250.2437 (5)0.3161 (3)0.2410 (4)0.067 (2)
H1250.24620.33990.27830.081*
C1260.3230 (5)0.2984 (3)0.2306 (4)0.058 (2)
H1260.37780.30980.26150.070*
C127−0.0569 (5)0.5129 (3)0.3545 (4)0.0530 (19)
C128−0.0611 (5)0.5072 (3)0.4121 (4)0.069 (2)
H128−0.01270.52680.44590.083*
C129−0.1353 (6)0.4730 (4)0.4208 (4)0.080 (3)
H129−0.13720.46900.45940.095*
C130−0.2070 (6)0.4450 (3)0.3691 (5)0.079 (3)
H130−0.25750.42200.37370.095*
C131−0.2057 (5)0.4502 (3)0.3125 (4)0.082 (3)
H131−0.25460.43130.27880.098*
C132−0.1293 (5)0.4844 (3)0.3058 (4)0.074 (2)
H132−0.12780.48790.26700.088*
C1330.1367 (4)0.5479 (3)0.4003 (3)0.0531 (19)
C1340.1461 (5)0.4905 (3)0.4067 (4)0.071 (2)
H1340.10270.45810.38150.085*
C1350.2193 (6)0.4814 (4)0.4501 (4)0.083 (3)
H1350.22280.44310.45610.100*
C1360.2869 (6)0.5282 (5)0.4844 (4)0.099 (3)
H1360.33880.52130.51110.119*
C1370.2781 (6)0.5846 (5)0.4792 (4)0.090 (3)
H1370.32180.61660.50460.108*
C1380.2043 (6)0.5949 (3)0.4364 (4)0.074 (3)
H1380.20040.63360.43190.089*
C1390.0435 (5)0.5382 (3)0.2722 (4)0.055 (2)
C1400.0980 (5)0.4981 (3)0.2568 (4)0.070 (2)
H1400.13230.48180.28660.084*
C1410.1017 (6)0.4820 (4)0.1968 (5)0.088 (3)
H1410.13780.45460.18670.106*
C1420.0521 (7)0.5066 (5)0.1528 (5)0.102 (3)
H1420.05540.49640.11300.123*
C143−0.0030 (6)0.5466 (4)0.1679 (5)0.094 (3)
H143−0.03800.56260.13800.113*
C144−0.0054 (5)0.5624 (4)0.2268 (4)0.074 (2)
H144−0.04090.59020.23680.089*
C145−0.0777 (4)0.7807 (3)0.4531 (4)0.054 (2)
C146−0.0865 (4)0.8085 (3)0.4039 (4)0.070 (2)
H146−0.09050.78650.36540.084*
C147−0.0891 (6)0.8697 (4)0.4132 (5)0.098 (3)
H147−0.09670.88900.38120.117*
C148−0.0803 (7)0.8994 (5)0.4703 (6)0.102 (4)
H148−0.08520.93950.47550.123*
C149−0.0652 (6)0.8772 (4)0.5209 (5)0.091 (3)
H149−0.05580.90110.55950.109*
C150−0.0645 (5)0.8150 (3)0.5109 (4)0.065 (2)
H150−0.05510.79700.54390.078*
C151−0.0506 (5)0.6838 (3)0.5120 (3)0.0534 (19)
C1520.0366 (6)0.6745 (3)0.5367 (5)0.080 (3)
H1520.07720.67550.51340.096*
C1530.0661 (7)0.6641 (4)0.5923 (6)0.111 (4)
H1530.12500.65690.60680.133*
C1540.0070 (10)0.6646 (4)0.6274 (6)0.124 (5)
H1540.02660.65790.66640.149*
C155−0.0812 (8)0.6747 (4)0.6062 (5)0.107 (4)
H155−0.12060.67540.63050.129*
C156−0.1087 (6)0.6836 (3)0.5480 (4)0.076 (2)
H156−0.16800.68960.53270.091*
C157−0.2003 (5)0.6687 (3)0.4065 (3)0.059 (2)
C158−0.2660 (5)0.7011 (3)0.3885 (4)0.080 (3)
H158−0.25050.74180.39130.096*
C159−0.3569 (6)0.6723 (4)0.3656 (4)0.098 (3)
H159−0.40140.69390.35090.118*
C160−0.3827 (6)0.6135 (5)0.3642 (4)0.091 (3)
H160−0.44410.59590.35210.109*
C161−0.3165 (6)0.5816 (4)0.3808 (4)0.085 (3)
H161−0.33240.54070.37670.102*
C162−0.2251 (5)0.6085 (3)0.4039 (4)0.077 (3)
H162−0.18090.58630.41760.093*
C1630.1680 (5)0.7233 (3)0.3206 (4)0.053 (2)
C1640.1622 (5)0.6884 (3)0.2635 (4)0.063 (2)
H1640.10580.67690.23410.076*
C1650.2375 (7)0.6708 (4)0.2499 (4)0.080 (3)
H1650.23160.64590.21240.096*
C1660.3209 (6)0.6898 (4)0.2911 (5)0.077 (3)
C1670.3300 (5)0.7249 (4)0.3467 (4)0.069 (2)
H1670.38760.73780.37450.083*
C1680.2540 (5)0.7415 (3)0.3622 (3)0.0494 (19)
N10.1697 (4)0.2419 (3)0.9078 (3)0.0549 (16)
H1A0.201 (7)0.243 (5)0.946 (3)0.082*
H1B0.157 (8)0.275 (3)0.908 (6)0.082*
N20.6592 (4)0.2460 (2)0.4159 (3)0.0513 (15)
H2A0.687 (7)0.245 (5)0.454 (3)0.077*
H2B0.646 (7)0.279 (3)0.417 (5)0.077*
N30.4027 (4)0.2477 (2)0.1658 (3)0.0453 (15)
H3A0.440 (6)0.246 (5)0.201 (3)0.068*
H3B0.391 (8)0.214 (3)0.139 (4)0.068*
N40.0885 (4)0.7379 (3)0.3341 (3)0.0533 (16)
H4A0.046 (6)0.741 (5)0.307 (4)0.080*
H4B0.104 (8)0.770 (3)0.362 (4)0.080*
O10.1189 (3)0.3065 (2)0.7386 (2)0.0778 (16)
O20.1320 (3)0.3368 (2)0.8465 (3)0.0813 (16)
O30.0289 (3)0.24717 (19)0.7861 (2)0.0671 (15)
O40.6098 (3)0.3387 (2)0.3545 (2)0.0715 (15)
O50.5195 (3)0.24505 (19)0.2890 (2)0.0632 (14)
O60.6054 (3)0.3125 (2)0.2474 (2)0.0769 (16)
O70.2778 (3)0.1565 (2)0.0668 (2)0.0804 (16)
O80.1395 (3)0.1901 (2)0.0223 (2)0.0889 (17)
O90.2870 (3)0.2482 (2)0.0327 (2)0.0749 (16)
O100.2153 (4)0.8336 (2)0.4249 (2)0.0819 (16)
O110.3597 (4)0.8041 (2)0.4666 (3)0.0975 (19)
O120.2174 (3)0.7445 (2)0.4635 (2)0.0782 (16)
P10.00610 (13)0.07371 (8)0.83137 (10)0.0566 (5)
P2−0.09104 (13)0.21763 (8)0.92183 (10)0.0544 (5)
P30.55376 (12)0.06892 (8)0.33884 (9)0.0522 (5)
P40.40134 (12)0.19756 (8)0.41339 (9)0.0485 (5)
P50.46462 (13)0.42654 (8)0.16345 (10)0.0564 (6)
P60.56177 (12)0.28953 (8)0.05733 (9)0.0489 (5)
P70.03721 (13)0.56412 (8)0.34845 (10)0.0542 (5)
P8−0.07843 (12)0.70087 (8)0.43783 (10)0.0527 (5)
S10.11387 (13)0.28755 (9)0.79372 (10)0.0601 (6)
S20.59964 (12)0.29081 (8)0.30089 (10)0.0551 (5)
S30.23400 (13)0.20682 (9)0.05674 (9)0.0606 (5)
S40.26396 (15)0.78513 (9)0.43523 (10)0.0682 (6)
Cl10.3668 (2)0.16776 (18)0.72775 (15)0.1756 (15)
Cl20.87604 (17)0.19052 (13)0.24361 (12)0.1175 (9)
Cl30.06543 (16)0.32049 (12)0.21181 (13)0.1191 (9)
Cl40.41655 (18)0.66937 (15)0.27116 (14)0.1425 (12)

Atomic displacement parameters (Å2)

U11U22U33U12U13U23
Ag10.0669 (4)0.0550 (4)0.1089 (6)0.0008 (3)0.0547 (4)0.0007 (4)
Ag20.0653 (4)0.0488 (4)0.0931 (5)0.0092 (3)0.0488 (4)0.0085 (3)
Ag30.0726 (4)0.0519 (4)0.0870 (5)0.0137 (3)0.0519 (4)0.0193 (3)
Ag40.0757 (4)0.0517 (4)0.1023 (6)0.0150 (3)0.0573 (4)0.0137 (4)
C10.042 (5)0.071 (5)0.056 (6)0.003 (4)0.022 (4)0.007 (4)
C20.089 (7)0.090 (6)0.061 (6)0.037 (5)0.035 (5)0.007 (5)
C30.086 (7)0.088 (7)0.123 (10)0.037 (6)0.039 (7)0.019 (7)
C40.076 (7)0.132 (9)0.104 (10)0.036 (6)0.022 (8)0.032 (8)
C50.062 (7)0.140 (10)0.088 (9)−0.008 (6)0.008 (6)0.033 (8)
C60.058 (6)0.091 (6)0.079 (8)0.012 (5)0.026 (5)0.003 (5)
C70.069 (5)0.052 (5)0.058 (6)0.017 (4)0.035 (4)0.020 (4)
C80.085 (6)0.069 (6)0.072 (7)0.030 (5)0.032 (5)0.023 (5)
C90.100 (7)0.085 (6)0.059 (7)0.022 (5)0.027 (6)0.024 (5)
C100.107 (8)0.136 (9)0.066 (8)0.035 (7)0.038 (6)0.030 (7)
C110.103 (7)0.111 (8)0.082 (8)0.039 (6)0.040 (6)0.068 (7)
C120.080 (6)0.048 (5)0.087 (7)0.019 (4)0.045 (5)0.030 (5)
C130.062 (5)0.041 (4)0.054 (5)0.003 (3)0.027 (4)0.003 (4)
C140.074 (6)0.068 (6)0.066 (6)0.004 (4)0.019 (5)0.024 (5)
C150.097 (7)0.075 (6)0.087 (7)0.018 (5)0.046 (6)0.038 (5)
C160.088 (7)0.083 (7)0.096 (8)0.002 (5)0.057 (6)0.026 (6)
C170.055 (5)0.071 (6)0.098 (7)0.008 (4)0.039 (5)0.014 (5)
C180.064 (5)0.056 (5)0.074 (6)0.001 (4)0.018 (5)0.023 (4)
C190.071 (5)0.047 (4)0.052 (6)0.021 (4)0.034 (5)0.016 (4)
C200.086 (7)0.054 (5)0.069 (7)0.015 (4)0.018 (6)0.005 (5)
C210.165 (11)0.056 (6)0.070 (8)0.034 (7)0.023 (9)0.014 (5)
C220.103 (9)0.078 (7)0.096 (10)0.020 (6)−0.023 (8)0.008 (7)
C230.066 (7)0.080 (7)0.119 (10)0.002 (5)0.015 (7)0.018 (7)
C240.060 (6)0.074 (6)0.075 (7)0.012 (4)0.016 (5)0.015 (5)
C250.070 (6)0.067 (5)0.058 (6)0.000 (5)0.039 (5)−0.003 (4)
C260.140 (9)0.054 (6)0.057 (6)0.010 (5)0.022 (6)0.007 (4)
C270.223 (14)0.064 (8)0.080 (9)0.034 (7)0.052 (9)0.020 (6)
C280.221 (17)0.071 (8)0.122 (12)0.016 (9)0.115 (12)0.004 (7)
C290.139 (11)0.066 (8)0.198 (14)−0.043 (6)0.122 (11)−0.028 (8)
C300.092 (7)0.074 (7)0.160 (10)−0.020 (5)0.082 (7)−0.032 (6)
C310.032 (4)0.054 (5)0.058 (6)0.005 (3)0.016 (4)0.004 (4)
C320.065 (5)0.072 (5)0.056 (6)0.012 (4)0.032 (5)0.009 (5)
C330.098 (7)0.076 (6)0.068 (7)0.006 (5)0.046 (5)0.002 (5)
C340.095 (7)0.105 (8)0.065 (7)0.025 (6)0.025 (6)0.027 (6)
C350.095 (7)0.075 (6)0.086 (8)0.040 (5)0.030 (6)0.025 (6)
C360.101 (7)0.074 (6)0.070 (7)0.035 (5)0.038 (5)0.027 (5)
C370.051 (5)0.117 (7)0.074 (7)0.016 (5)0.023 (5)0.037 (6)
C380.033 (4)0.072 (5)0.028 (5)−0.002 (3)0.005 (4)0.014 (4)
C390.048 (5)0.059 (5)0.065 (6)−0.015 (4)0.018 (5)0.013 (4)
C400.058 (6)0.100 (7)0.064 (7)0.022 (5)0.010 (5)0.028 (5)
C410.051 (6)0.138 (8)0.093 (9)0.047 (5)0.014 (6)0.032 (7)
C420.053 (6)0.150 (9)0.065 (7)0.032 (5)0.028 (5)0.024 (6)
C430.054 (5)0.050 (5)0.055 (5)0.005 (3)0.021 (4)0.005 (4)
C440.064 (5)0.062 (5)0.060 (6)0.007 (4)0.019 (5)0.009 (4)
C450.053 (5)0.085 (7)0.089 (8)0.001 (5)0.024 (5)0.012 (5)
C460.076 (7)0.068 (6)0.104 (9)−0.012 (5)0.040 (6)0.008 (5)
C470.110 (8)0.088 (7)0.104 (8)−0.003 (6)0.038 (7)0.059 (6)
C480.059 (5)0.090 (6)0.103 (8)0.001 (4)0.026 (5)0.043 (6)
C490.059 (5)0.054 (5)0.074 (7)0.010 (4)0.020 (5)0.030 (5)
C500.084 (7)0.062 (6)0.100 (9)0.007 (5)0.017 (6)0.031 (6)
C510.118 (11)0.060 (7)0.108 (10)−0.017 (6)−0.022 (8)0.033 (7)
C520.064 (8)0.111 (11)0.197 (18)−0.001 (7)0.002 (9)0.102 (12)
C530.063 (7)0.143 (10)0.143 (12)0.053 (7)0.045 (7)0.072 (9)
C540.065 (6)0.097 (7)0.099 (8)0.034 (5)0.028 (6)0.023 (6)
C550.051 (4)0.050 (5)0.047 (5)0.011 (3)0.020 (4)0.009 (4)
C560.095 (6)0.056 (6)0.075 (7)−0.003 (4)0.024 (6)0.010 (5)
C570.142 (9)0.098 (8)0.074 (8)−0.011 (6)0.047 (7)0.003 (6)
C580.173 (11)0.113 (9)0.078 (9)0.013 (8)0.065 (8)0.035 (8)
C590.178 (11)0.106 (9)0.101 (10)0.034 (8)0.065 (9)0.055 (8)
C600.109 (7)0.063 (6)0.072 (7)0.005 (5)0.034 (6)0.020 (5)
C610.054 (4)0.056 (5)0.047 (5)0.020 (3)0.021 (4)0.025 (4)
C620.151 (8)0.058 (6)0.115 (8)0.036 (5)0.104 (7)0.026 (5)
C630.196 (10)0.081 (7)0.128 (9)0.061 (7)0.136 (9)0.046 (6)
C640.094 (6)0.084 (7)0.094 (8)0.034 (5)0.067 (6)0.053 (6)
C650.104 (7)0.062 (6)0.080 (7)0.006 (5)0.028 (6)0.025 (5)
C660.127 (7)0.057 (5)0.037 (5)0.017 (5)0.027 (5)0.012 (4)
C670.065 (6)0.041 (4)0.061 (6)0.002 (3)0.013 (5)0.012 (4)
C680.101 (7)0.059 (5)0.062 (7)0.002 (4)0.021 (6)0.028 (5)
C690.149 (10)0.082 (7)0.040 (7)−0.012 (7)−0.021 (8)0.025 (5)
C700.115 (10)0.093 (8)0.096 (11)−0.027 (7)−0.048 (9)0.026 (8)
C710.069 (7)0.098 (8)0.128 (11)−0.002 (5)−0.003 (8)0.040 (8)
C720.058 (6)0.105 (7)0.072 (7)0.014 (5)0.011 (6)0.010 (5)
C730.042 (4)0.054 (5)0.058 (6)0.007 (4)0.024 (4)0.018 (4)
C740.070 (6)0.067 (6)0.087 (7)0.019 (4)0.036 (5)0.024 (5)
C750.079 (7)0.082 (7)0.093 (8)−0.008 (5)0.039 (6)−0.018 (6)
C760.117 (10)0.072 (8)0.167 (13)0.018 (7)0.097 (9)0.006 (8)
C770.111 (9)0.054 (7)0.146 (11)0.020 (6)0.054 (8)0.031 (7)
C780.078 (6)0.063 (6)0.114 (8)0.021 (5)0.048 (6)0.024 (6)
C790.026 (4)0.061 (4)0.044 (5)0.005 (3)0.005 (4)0.016 (4)
C800.050 (5)0.053 (4)0.050 (5)0.006 (3)0.012 (4)0.025 (4)
C810.051 (5)0.068 (5)0.084 (7)0.008 (4)0.016 (5)0.020 (5)
C820.074 (6)0.076 (6)0.064 (7)0.018 (5)0.035 (5)0.000 (5)
C830.055 (5)0.064 (5)0.058 (6)0.009 (4)0.012 (4)0.022 (4)
C840.030 (4)0.069 (5)0.039 (5)0.003 (3)0.011 (4)0.012 (4)
C850.051 (5)0.052 (5)0.074 (6)0.005 (4)0.035 (5)0.018 (4)
C860.071 (6)0.076 (6)0.083 (7)0.024 (5)0.025 (5)0.010 (5)
C870.088 (7)0.095 (7)0.132 (10)0.025 (5)0.078 (8)0.005 (7)
C880.110 (9)0.103 (8)0.098 (10)−0.016 (6)0.062 (8)0.012 (7)
C890.086 (7)0.096 (7)0.054 (6)−0.004 (5)0.030 (5)0.025 (5)
C900.078 (6)0.065 (5)0.083 (7)0.013 (4)0.037 (6)0.023 (5)
C910.045 (5)0.061 (5)0.065 (6)0.002 (4)0.013 (4)0.012 (4)
C920.073 (6)0.110 (8)0.092 (8)−0.008 (5)−0.005 (6)0.049 (6)
C930.119 (10)0.156 (11)0.106 (10)−0.021 (8)−0.023 (8)0.071 (9)
C940.122 (12)0.210 (17)0.104 (11)0.047 (12)0.007 (9)0.057 (12)
C950.060 (8)0.164 (13)0.143 (13)0.016 (8)−0.010 (8)0.001 (10)
C960.060 (6)0.084 (7)0.131 (10)0.006 (5)0.019 (6)0.001 (6)
C970.054 (5)0.049 (5)0.073 (6)0.015 (4)0.026 (4)0.022 (4)
C980.104 (7)0.039 (5)0.155 (10)0.001 (4)0.085 (7)0.011 (5)
C990.120 (8)0.072 (7)0.212 (13)0.020 (6)0.122 (9)0.029 (8)
C1000.057 (6)0.082 (7)0.130 (10)0.005 (5)0.039 (6)0.044 (7)
C1010.079 (7)0.083 (6)0.081 (7)−0.014 (5)0.016 (6)0.000 (5)
C1020.077 (6)0.079 (6)0.074 (7)−0.009 (5)0.035 (5)0.005 (5)
C1030.047 (5)0.054 (5)0.061 (6)0.015 (3)0.022 (4)0.026 (4)
C1040.090 (6)0.092 (6)0.046 (6)0.029 (5)0.019 (5)0.029 (5)
C1050.137 (9)0.104 (7)0.038 (6)0.017 (6)0.024 (6)0.027 (5)
C1060.137 (10)0.116 (9)0.102 (11)0.014 (7)0.008 (8)0.065 (8)
C1070.115 (9)0.097 (7)0.091 (9)0.039 (6)0.006 (7)0.046 (7)
C1080.084 (6)0.089 (6)0.085 (8)0.034 (5)0.030 (6)0.026 (6)
C1090.047 (4)0.062 (5)0.047 (5)0.013 (3)0.026 (4)0.020 (4)
C1100.076 (6)0.071 (6)0.063 (6)0.003 (4)0.024 (5)0.024 (5)
C1110.083 (7)0.077 (6)0.084 (7)0.007 (5)0.015 (6)0.012 (5)
C1120.043 (5)0.066 (6)0.106 (8)−0.001 (4)0.027 (5)0.009 (5)
C1130.069 (6)0.081 (6)0.068 (7)0.005 (5)0.033 (5)0.023 (5)
C1140.062 (5)0.076 (5)0.059 (6)0.012 (4)0.029 (5)0.030 (4)
C1150.040 (4)0.052 (4)0.039 (5)0.008 (3)0.013 (4)0.017 (3)
C1160.053 (5)0.070 (6)0.080 (7)0.004 (4)0.009 (5)0.016 (5)
C1170.084 (7)0.074 (7)0.106 (8)−0.021 (5)0.006 (6)0.017 (6)
C1180.102 (7)0.056 (6)0.087 (8)0.005 (5)0.022 (6)0.023 (5)
C1190.100 (7)0.056 (6)0.115 (8)0.031 (5)0.057 (6)0.010 (5)
C1200.055 (5)0.064 (5)0.093 (7)0.009 (4)0.031 (5)0.021 (5)
C1210.046 (5)0.054 (5)0.035 (5)−0.004 (3)0.011 (4)0.011 (4)
C1220.038 (4)0.060 (5)0.054 (5)0.000 (3)0.022 (4)0.022 (4)
C1230.040 (5)0.090 (6)0.056 (6)0.008 (4)0.008 (4)0.030 (5)
C1240.042 (5)0.080 (6)0.060 (6)0.014 (4)0.010 (5)0.026 (5)
C1250.068 (6)0.065 (5)0.073 (7)0.007 (4)0.034 (5)0.009 (4)
C1260.043 (5)0.066 (5)0.062 (6)0.001 (4)0.008 (4)0.020 (4)
C1270.050 (5)0.053 (5)0.058 (6)0.008 (4)0.020 (4)0.012 (4)
C1280.059 (5)0.075 (6)0.081 (7)0.004 (4)0.031 (5)0.023 (5)
C1290.071 (6)0.082 (6)0.104 (8)0.014 (5)0.052 (6)0.029 (6)
C1300.064 (6)0.068 (6)0.126 (9)0.007 (4)0.052 (7)0.037 (6)
C1310.063 (6)0.075 (6)0.098 (8)−0.006 (4)0.022 (6)0.010 (5)
C1320.065 (6)0.080 (6)0.072 (7)0.000 (5)0.025 (5)0.009 (5)
C1330.056 (5)0.039 (4)0.066 (6)0.000 (4)0.031 (4)0.004 (4)
C1340.049 (5)0.068 (6)0.089 (7)0.007 (4)0.022 (5)−0.005 (5)
C1350.065 (6)0.098 (7)0.106 (8)0.032 (6)0.034 (6)0.048 (6)
C1360.061 (7)0.153 (10)0.086 (8)0.023 (7)0.029 (6)0.021 (8)
C1370.049 (6)0.113 (8)0.076 (8)−0.007 (5)0.004 (5)−0.021 (6)
C1380.065 (6)0.057 (5)0.110 (8)0.004 (4)0.049 (6)0.014 (5)
C1390.049 (5)0.053 (5)0.067 (6)0.004 (3)0.027 (4)0.013 (4)
C1400.076 (6)0.086 (6)0.061 (6)0.027 (5)0.037 (5)0.015 (5)
C1410.105 (8)0.092 (7)0.075 (8)0.017 (5)0.044 (7)0.009 (6)
C1420.132 (10)0.103 (8)0.064 (8)−0.017 (7)0.051 (7)−0.007 (6)
C1430.103 (8)0.094 (8)0.081 (9)−0.003 (6)0.014 (7)0.037 (6)
C1440.074 (6)0.089 (6)0.054 (6)0.012 (5)0.013 (5)0.015 (5)
C1450.039 (4)0.055 (5)0.077 (6)0.009 (3)0.027 (4)0.022 (5)
C1460.071 (5)0.054 (5)0.101 (7)0.016 (4)0.041 (5)0.031 (5)
C1470.085 (7)0.099 (9)0.134 (11)0.029 (6)0.047 (8)0.056 (7)
C1480.088 (7)0.079 (8)0.158 (13)0.031 (6)0.049 (9)0.037 (8)
C1490.100 (7)0.076 (7)0.096 (9)0.024 (5)0.044 (7)−0.005 (6)
C1500.078 (6)0.046 (5)0.073 (7)0.010 (4)0.026 (5)0.010 (4)
C1510.051 (5)0.050 (4)0.055 (6)0.004 (3)0.006 (4)0.018 (4)
C1520.069 (7)0.054 (5)0.096 (8)−0.005 (4)−0.003 (6)0.013 (5)
C1530.084 (8)0.066 (6)0.140 (13)−0.007 (5)−0.037 (8)0.033 (7)
C1540.143 (12)0.076 (7)0.125 (12)−0.027 (8)−0.010 (10)0.050 (7)
C1550.143 (10)0.094 (7)0.088 (9)−0.023 (7)0.050 (8)0.030 (6)
C1560.098 (7)0.078 (6)0.059 (7)0.011 (5)0.035 (6)0.020 (5)
C1570.048 (5)0.070 (5)0.056 (6)0.018 (4)0.023 (4)−0.008 (4)
C1580.063 (6)0.057 (5)0.113 (8)0.014 (4)0.017 (6)0.009 (5)
C1590.058 (6)0.094 (7)0.113 (9)0.016 (5)0.005 (6)−0.021 (6)
C1600.053 (6)0.116 (8)0.087 (8)−0.010 (6)0.031 (6)−0.019 (6)
C1610.063 (6)0.079 (6)0.107 (8)−0.013 (5)0.025 (6)0.025 (6)
C1620.060 (6)0.070 (6)0.100 (7)0.006 (4)0.011 (5)0.036 (5)
C1630.063 (6)0.060 (5)0.038 (5)0.006 (4)0.017 (5)0.021 (4)
C1640.054 (5)0.070 (5)0.077 (7)0.005 (4)0.021 (5)0.042 (5)
C1650.089 (7)0.086 (6)0.076 (7)0.018 (5)0.032 (6)0.034 (5)
C1660.061 (6)0.122 (8)0.077 (8)0.040 (5)0.039 (6)0.048 (6)
C1670.051 (5)0.105 (7)0.062 (7)0.016 (5)0.016 (5)0.041 (6)
C1680.052 (5)0.069 (5)0.031 (5)0.009 (4)0.010 (4)0.023 (4)
N10.048 (4)0.085 (4)0.029 (4)0.000 (3)0.014 (3)0.012 (3)
N20.051 (4)0.058 (4)0.051 (4)0.009 (3)0.025 (3)0.013 (3)
N30.033 (3)0.054 (4)0.047 (4)0.007 (3)0.008 (3)0.013 (3)
N40.041 (4)0.062 (4)0.062 (5)0.013 (3)0.019 (3)0.018 (3)
O10.077 (4)0.093 (4)0.067 (4)0.007 (3)0.011 (3)0.046 (3)
O20.101 (4)0.055 (3)0.085 (5)0.011 (3)0.026 (4)0.013 (3)
O30.047 (3)0.062 (3)0.084 (4)0.002 (2)0.008 (3)0.016 (3)
O40.086 (4)0.058 (3)0.071 (4)0.014 (3)0.022 (3)0.015 (3)
O50.038 (3)0.069 (3)0.082 (4)0.004 (2)0.014 (3)0.024 (3)
O60.060 (3)0.125 (5)0.058 (4)0.025 (3)0.011 (3)0.055 (4)
O70.101 (4)0.061 (4)0.067 (4)0.001 (3)0.015 (3)0.006 (3)
O80.049 (3)0.132 (5)0.065 (4)−0.003 (3)0.000 (3)0.007 (4)
O90.076 (4)0.098 (4)0.060 (4)0.000 (3)0.028 (3)0.036 (3)
O100.103 (4)0.067 (4)0.070 (4)0.020 (3)0.015 (3)0.015 (3)
O110.078 (4)0.115 (5)0.080 (5)−0.003 (3)−0.010 (4)0.034 (4)
O120.113 (4)0.075 (4)0.047 (4)0.004 (3)0.029 (3)0.016 (3)
P10.0596 (13)0.0475 (12)0.0681 (16)0.0085 (9)0.0321 (12)0.0079 (10)
P20.0540 (12)0.0494 (12)0.0648 (15)0.0042 (9)0.0336 (11)0.0058 (10)
P30.0484 (12)0.0475 (12)0.0643 (15)0.0092 (9)0.0249 (11)0.0090 (10)
P40.0478 (12)0.0505 (12)0.0540 (14)0.0135 (9)0.0228 (10)0.0137 (10)
P50.0526 (13)0.0482 (12)0.0751 (17)0.0102 (9)0.0292 (12)0.0148 (11)
P60.0486 (12)0.0564 (12)0.0481 (14)0.0113 (9)0.0215 (10)0.0156 (10)
P70.0567 (13)0.0432 (12)0.0682 (16)0.0082 (9)0.0318 (12)0.0075 (10)
P80.0498 (12)0.0509 (12)0.0625 (15)0.0109 (9)0.0268 (11)0.0090 (10)
S10.0531 (12)0.0568 (13)0.0667 (16)0.0024 (9)0.0087 (11)0.0217 (11)
S20.0484 (12)0.0628 (13)0.0566 (15)0.0100 (9)0.0107 (10)0.0256 (11)
S30.0528 (13)0.0792 (15)0.0437 (14)−0.0044 (10)0.0095 (11)0.0159 (11)
S40.0786 (16)0.0677 (14)0.0566 (16)0.0080 (11)0.0101 (13)0.0265 (12)
Cl10.138 (3)0.292 (4)0.132 (3)0.098 (3)0.083 (2)0.034 (3)
Cl20.115 (2)0.164 (2)0.102 (2)0.0525 (18)0.0689 (18)0.0308 (19)
Cl30.0755 (16)0.152 (2)0.142 (3)0.0472 (15)0.0512 (17)0.0188 (19)
Cl40.107 (2)0.232 (3)0.134 (3)0.084 (2)0.070 (2)0.069 (3)

Geometric parameters (Å, °)

Ag1—N12.337 (6)C86—H860.93
Ag1—P22.446 (2)C87—C881.359 (11)
Ag1—P12.452 (2)C87—H870.93
Ag2—N22.356 (6)C88—C891.361 (11)
Ag2—P42.4268 (19)C88—H880.93
Ag2—P32.4288 (19)C89—C901.390 (10)
Ag3—N32.346 (5)C89—H890.93
Ag3—P62.453 (2)C90—H900.93
Ag3—P52.4592 (19)C91—C961.370 (10)
Ag4—N42.327 (6)C91—C921.387 (9)
Ag4—P82.433 (2)C91—P51.807 (7)
Ag4—P72.4390 (19)C92—C931.362 (11)
C1—C21.363 (9)C92—H920.93
C1—C61.396 (10)C93—C941.359 (14)
C1—P11.811 (7)C93—H930.93
C2—C31.386 (10)C94—C951.331 (13)
C2—H20.93C94—H940.93
C3—C41.398 (12)C95—C961.381 (13)
C3—H30.93C95—H950.93
C4—C51.354 (12)C96—H960.93
C4—H40.93C97—C981.356 (9)
C5—C61.369 (10)C97—C1021.360 (10)
C5—H50.93C97—P51.819 (7)
C6—H60.93C98—C991.398 (10)
C7—C121.378 (8)C98—H980.93
C7—C81.402 (9)C99—C1001.373 (12)
C7—P11.797 (7)C99—H990.93
C8—C91.386 (10)C100—C1011.331 (10)
C8—H80.93C100—H1000.93
C9—C101.322 (10)C101—C1021.430 (9)
C9—H90.93C101—H1010.93
C10—C111.359 (11)C102—H1020.93
C10—H100.93C103—C1041.377 (9)
C11—C121.378 (11)C103—C1081.383 (9)
C11—H110.93C103—P61.810 (7)
C12—H120.93C104—C1051.356 (9)
C13—C181.379 (8)C104—H1040.93
C13—C141.384 (8)C105—C1061.369 (11)
C13—P11.832 (6)C105—H1050.93
C14—C151.412 (9)C106—C1071.389 (12)
C14—H140.93C106—H1060.93
C15—C161.343 (9)C107—C1081.367 (11)
C15—H150.93C107—H1070.93
C16—C171.391 (9)C108—H1080.93
C16—H160.93C109—C1141.365 (8)
C17—C181.387 (8)C109—C1101.401 (9)
C17—H170.93C109—P61.812 (7)
C18—H180.93C110—C1111.370 (10)
C19—C201.365 (10)C110—H1100.93
C19—C241.405 (9)C111—C1121.374 (10)
C19—P21.786 (8)C111—H1110.93
C20—C211.348 (11)C112—C1131.337 (10)
C20—H200.93C112—H1120.93
C21—C221.375 (12)C113—C1141.368 (9)
C21—H210.93C113—H1130.93
C22—C231.351 (12)C114—H1140.93
C22—H220.93C115—C1161.353 (8)
C23—C241.387 (10)C115—C1201.363 (8)
C23—H230.93C115—P61.826 (6)
C24—H240.93C116—C1171.371 (10)
C25—C301.385 (11)C116—H1160.93
C25—C261.392 (10)C117—C1181.394 (10)
C25—P21.810 (8)C117—H1170.93
C26—C271.397 (11)C118—C1191.346 (10)
C26—H260.93C118—H1180.93
C27—C281.370 (14)C119—C1201.390 (9)
C27—H270.93C119—H1190.93
C28—C291.355 (14)C120—H1200.93
C28—H280.93C121—C1261.369 (9)
C29—C301.412 (11)C121—C1221.373 (9)
C29—H290.93C121—N31.428 (8)
C30—H300.93C122—C1231.421 (8)
C31—C321.361 (9)C122—S31.764 (7)
C31—C361.399 (9)C123—C1241.371 (10)
C31—P21.800 (7)C123—H1230.93
C32—C331.394 (9)C124—C1251.342 (9)
C32—H320.93C124—Cl31.756 (7)
C33—C341.360 (10)C125—C1261.397 (9)
C33—H330.93C125—H1250.93
C34—C351.342 (10)C126—H1260.93
C34—H340.93C127—C1321.364 (9)
C35—C361.380 (9)C127—C1281.393 (9)
C35—H350.93C127—P71.810 (7)
C36—H360.93C128—C1291.390 (9)
C37—C381.370 (9)C128—H1280.93
C37—C421.384 (10)C129—C1301.393 (11)
C37—H370.93C129—H1290.93
C38—C391.385 (9)C130—C1311.352 (10)
C38—S11.767 (7)C130—H1300.93
C39—N11.402 (9)C131—C1321.397 (9)
C39—C401.404 (9)C131—H1310.93
C40—C411.374 (10)C132—H1320.93
C40—H400.93C133—C1381.382 (9)
C41—C421.365 (10)C133—C1341.386 (9)
C41—H410.93C133—P71.820 (7)
C42—Cl11.733 (8)C134—C1351.378 (10)
C43—C481.350 (9)C134—H1340.93
C43—C441.403 (9)C135—C1361.369 (11)
C43—P31.823 (7)C135—H1350.93
C44—C451.385 (9)C136—C1371.355 (11)
C44—H440.93C136—H1360.93
C45—C461.363 (10)C137—C1381.386 (10)
C45—H450.93C137—H1370.93
C46—C471.363 (10)C138—H1380.93
C46—H460.93C139—C1401.383 (9)
C47—C481.390 (9)C139—C1441.385 (9)
C47—H470.93C139—P71.800 (8)
C48—H480.93C140—C1411.397 (10)
C49—C501.363 (11)C140—H1400.93
C49—C541.386 (10)C141—C1421.373 (11)
C49—P31.812 (7)C141—H1410.93
C50—C511.395 (12)C142—C1431.389 (11)
C50—H500.93C142—H1420.93
C51—C521.354 (14)C143—C1441.367 (11)
C51—H510.93C143—H1430.93
C52—C531.328 (14)C144—H1440.93
C52—H520.93C145—C1501.382 (10)
C53—C541.392 (10)C145—C1461.404 (9)
C53—H530.93C145—P81.815 (7)
C54—H540.93C146—C1471.401 (10)
C55—C601.386 (9)C146—H1460.93
C55—C561.405 (9)C147—C1481.344 (13)
C55—P31.806 (7)C147—H1470.93
C56—C571.366 (10)C148—C1491.352 (12)
C56—H560.93C148—H1480.93
C57—C581.343 (11)C149—C1501.419 (10)
C57—H570.93C149—H1490.93
C58—C591.338 (12)C150—H1500.93
C58—H580.93C151—C1561.376 (9)
C59—C601.353 (11)C151—C1521.380 (9)
C59—H590.93C151—P81.802 (7)
C60—H600.93C152—C1531.337 (12)
C61—C621.354 (9)C152—H1520.93
C61—C661.377 (8)C153—C1541.372 (14)
C61—P41.829 (6)C153—H1530.93
C62—C631.371 (9)C154—C1551.387 (13)
C62—H620.93C154—H1540.93
C63—C641.364 (10)C155—C1561.377 (11)
C63—H630.93C155—H1550.93
C64—C651.344 (10)C156—H1560.93
C64—H640.93C157—C1581.360 (9)
C65—C661.388 (9)C157—C1621.385 (9)
C65—H650.93C157—P81.835 (7)
C66—H660.93C158—C1591.395 (10)
C67—C681.369 (10)C158—H1580.93
C67—C721.400 (9)C159—C1601.363 (10)
C67—P41.823 (8)C159—H1590.93
C68—C691.390 (10)C160—C1611.353 (10)
C68—H680.93C160—H1600.93
C69—C701.368 (13)C161—C1621.390 (9)
C69—H690.93C161—H1610.93
C70—C711.366 (14)C162—H1620.93
C70—H700.93C163—C1681.388 (9)
C71—C721.367 (11)C163—C1641.397 (10)
C71—H710.93C163—N41.405 (9)
C72—H720.93C164—C1651.368 (9)
C73—C741.349 (9)C164—H1640.93
C73—C781.390 (9)C165—C1661.356 (11)
C73—P41.805 (7)C165—H1650.93
C74—C751.406 (10)C166—C1671.358 (11)
C74—H740.93C166—Cl41.747 (8)
C75—C761.357 (11)C167—C1681.389 (9)
C75—H750.93C167—H1670.93
C76—C771.343 (12)C168—S41.769 (7)
C76—H760.93N1—H1A0.90 (5)
C77—C781.377 (11)N1—H1B0.82 (5)
C77—H770.93N2—H2A0.89 (4)
C78—H780.93N2—H2B0.82 (4)
C79—C841.380 (8)N3—H3A0.88 (5)
C79—C801.388 (8)N3—H3B0.86 (5)
C79—N21.419 (8)N4—H4A0.81 (5)
C80—C811.380 (9)N4—H4B0.85 (5)
C80—H800.93O1—S11.452 (5)
C81—C821.384 (10)O2—S11.455 (5)
C81—H810.93O3—S11.462 (4)
C82—C831.365 (9)O4—S21.470 (5)
C82—Cl21.752 (8)O5—S21.456 (4)
C83—C841.393 (9)O6—S21.448 (4)
C83—H830.93O7—S31.444 (5)
C84—S21.786 (6)O8—S31.435 (5)
C85—C901.367 (9)O9—S31.464 (4)
C85—C861.405 (9)O10—S41.448 (5)
C85—P51.798 (7)O11—S41.438 (5)
C86—C871.387 (11)O12—S41.464 (5)
N1—Ag1—P2117.59 (17)C100—C99—C98118.6 (9)
N1—Ag1—P1121.19 (17)C100—C99—H99120.7
P2—Ag1—P1120.18 (6)C98—C99—H99120.7
N2—Ag2—P4112.43 (15)C101—C100—C99121.1 (8)
N2—Ag2—P3117.99 (15)C101—C100—H100119.5
P4—Ag2—P3129.55 (6)C99—C100—H100119.5
N3—Ag3—P6117.72 (15)C100—C101—C102119.6 (8)
N3—Ag3—P5119.52 (15)C100—C101—H101120.2
P6—Ag3—P5122.68 (6)C102—C101—H101120.2
N4—Ag4—P8117.92 (16)C97—C102—C101120.0 (8)
N4—Ag4—P7118.76 (16)C97—C102—H102120.0
P8—Ag4—P7123.29 (6)C101—C102—H102120.0
C2—C1—C6117.3 (7)C104—C103—C108117.8 (7)
C2—C1—P1127.0 (7)C104—C103—P6122.3 (5)
C6—C1—P1115.7 (6)C108—C103—P6119.9 (6)
C1—C2—C3123.0 (9)C105—C104—C103121.6 (8)
C1—C2—H2118.5C105—C104—H104119.2
C3—C2—H2118.5C103—C104—H104119.2
C2—C3—C4116.8 (9)C104—C105—C106120.6 (9)
C2—C3—H3121.6C104—C105—H105119.7
C4—C3—H3121.6C106—C105—H105119.7
C5—C4—C3122.1 (10)C105—C106—C107118.9 (10)
C5—C4—H4118.9C105—C106—H106120.6
C3—C4—H4118.9C107—C106—H106120.6
C4—C5—C6118.9 (10)C108—C107—C106119.9 (10)
C4—C5—H5120.6C108—C107—H107120.0
C6—C5—H5120.6C106—C107—H107120.0
C5—C6—C1121.9 (9)C107—C108—C103121.1 (9)
C5—C6—H6119.1C107—C108—H108119.4
C1—C6—H6119.1C103—C108—H108119.4
C12—C7—C8117.3 (7)C114—C109—C110117.3 (7)
C12—C7—P1121.7 (6)C114—C109—P6126.7 (6)
C8—C7—P1120.8 (6)C110—C109—P6115.9 (5)
C9—C8—C7119.8 (7)C111—C110—C109120.3 (7)
C9—C8—H8120.1C111—C110—H110119.9
C7—C8—H8120.1C109—C110—H110119.9
C10—C9—C8121.9 (9)C110—C111—C112120.4 (8)
C10—C9—H9119.1C110—C111—H111119.8
C8—C9—H9119.1C112—C111—H111119.8
C9—C10—C11119.3 (10)C113—C112—C111119.3 (8)
C9—C10—H10120.4C113—C112—H112120.4
C11—C10—H10120.4C111—C112—H112120.4
C10—C11—C12121.3 (8)C112—C113—C114121.2 (7)
C10—C11—H11119.3C112—C113—H113119.4
C12—C11—H11119.3C114—C113—H113119.4
C11—C12—C7120.4 (8)C109—C114—C113121.3 (7)
C11—C12—H12119.8C109—C114—H114119.3
C7—C12—H12119.8C113—C114—H114119.3
C18—C13—C14119.1 (6)C116—C115—C120118.9 (7)
C18—C13—P1117.7 (5)C116—C115—P6117.9 (6)
C14—C13—P1123.2 (6)C120—C115—P6123.2 (5)
C13—C14—C15120.2 (7)C115—C116—C117120.0 (7)
C13—C14—H14119.9C115—C116—H116120.0
C15—C14—H14119.9C117—C116—H116120.0
C16—C15—C14120.3 (7)C116—C117—C118121.6 (8)
C16—C15—H15119.9C116—C117—H117119.2
C14—C15—H15119.9C118—C117—H117119.2
C15—C16—C17119.5 (7)C119—C118—C117117.7 (8)
C15—C16—H16120.2C119—C118—H118121.1
C17—C16—H16120.2C117—C118—H118121.1
C18—C17—C16120.8 (7)C118—C119—C120120.4 (8)
C18—C17—H17119.6C118—C119—H119119.8
C16—C17—H17119.6C120—C119—H119119.8
C13—C18—C17119.9 (7)C115—C120—C119121.4 (7)
C13—C18—H18120.1C115—C120—H120119.3
C17—C18—H18120.1C119—C120—H120119.3
C20—C19—C24117.5 (8)C126—C121—C122119.7 (7)
C20—C19—P2119.0 (6)C126—C121—N3119.0 (7)
C24—C19—P2123.4 (6)C122—C121—N3121.3 (7)
C21—C20—C19121.8 (9)C121—C122—C123119.8 (7)
C21—C20—H20119.1C121—C122—S3121.0 (6)
C19—C20—H20119.1C123—C122—S3119.1 (6)
C20—C21—C22120.8 (10)C124—C123—C122118.5 (7)
C20—C21—H21119.6C124—C123—H123120.7
C22—C21—H21119.6C122—C123—H123120.7
C23—C22—C21119.5 (10)C125—C124—C123121.6 (7)
C23—C22—H22120.2C125—C124—Cl3118.8 (7)
C21—C22—H22120.2C123—C124—Cl3119.5 (6)
C22—C23—C24120.1 (10)C124—C125—C126119.9 (8)
C22—C23—H23119.9C124—C125—H125120.0
C24—C23—H23119.9C126—C125—H125120.0
C23—C24—C19120.1 (8)C121—C126—C125120.3 (7)
C23—C24—H24119.9C121—C126—H126119.8
C19—C24—H24119.9C125—C126—H126119.8
C30—C25—C26118.6 (8)C132—C127—C128117.9 (7)
C30—C25—P2118.9 (7)C132—C127—P7123.0 (6)
C26—C25—P2122.5 (6)C128—C127—P7118.7 (6)
C25—C26—C27122.0 (10)C129—C128—C127122.0 (8)
C25—C26—H26119.0C129—C128—H128119.0
C27—C26—H26119.0C127—C128—H128119.0
C28—C27—C26118.5 (12)C128—C129—C130117.2 (8)
C28—C27—H27120.8C128—C129—H129121.4
C26—C27—H27120.8C130—C129—H129121.4
C29—C28—C27120.5 (12)C131—C130—C129122.4 (8)
C29—C28—H28119.7C131—C130—H130118.8
C27—C28—H28119.7C129—C130—H130118.8
C28—C29—C30121.7 (12)C130—C131—C132118.7 (8)
C28—C29—H29119.1C130—C131—H131120.7
C30—C29—H29119.1C132—C131—H131120.7
C25—C30—C29118.6 (10)C127—C132—C131121.9 (8)
C25—C30—H30120.7C127—C132—H132119.1
C29—C30—H30120.7C131—C132—H132119.1
C32—C31—C36118.1 (7)C138—C133—C134118.5 (7)
C32—C31—P2124.6 (6)C138—C133—P7118.7 (6)
C36—C31—P2117.2 (6)C134—C133—P7122.7 (6)
C31—C32—C33120.8 (7)C135—C134—C133120.2 (7)
C31—C32—H32119.6C135—C134—H134119.9
C33—C32—H32119.6C133—C134—H134119.9
C34—C33—C32118.6 (8)C136—C135—C134120.5 (8)
C34—C33—H33120.7C136—C135—H135119.8
C32—C33—H33120.7C134—C135—H135119.8
C35—C34—C33122.8 (9)C137—C136—C135119.7 (9)
C35—C34—H34118.6C137—C136—H136120.1
C33—C34—H34118.6C135—C136—H136120.1
C34—C35—C36118.4 (8)C136—C137—C138120.6 (9)
C34—C35—H35120.8C136—C137—H137119.7
C36—C35—H35120.8C138—C137—H137119.7
C35—C36—C31121.2 (8)C133—C138—C137120.2 (7)
C35—C36—H36119.4C133—C138—H138119.9
C31—C36—H36119.4C137—C138—H138119.9
C38—C37—C42120.0 (8)C140—C139—C144118.1 (8)
C38—C37—H37120.0C140—C139—P7124.1 (6)
C42—C37—H37120.0C144—C139—P7117.7 (6)
C37—C38—C39121.0 (7)C139—C140—C141120.5 (8)
C37—C38—S1119.8 (6)C139—C140—H140119.7
C39—C38—S1119.1 (6)C141—C140—H140119.7
C38—C39—N1122.0 (7)C142—C141—C140119.9 (9)
C38—C39—C40118.4 (8)C142—C141—H141120.0
N1—C39—C40119.6 (7)C140—C141—H141120.0
C41—C40—C39119.8 (8)C141—C142—C143119.9 (9)
C41—C40—H40120.1C141—C142—H142120.1
C39—C40—H40120.1C143—C142—H142120.1
C42—C41—C40121.0 (8)C144—C143—C142119.5 (9)
C42—C41—H41119.5C144—C143—H143120.3
C40—C41—H41119.5C142—C143—H143120.3
C41—C42—C37119.7 (8)C143—C144—C139122.0 (9)
C41—C42—Cl1119.7 (8)C143—C144—H144119.0
C37—C42—Cl1120.5 (8)C139—C144—H144119.0
C48—C43—C44119.5 (6)C150—C145—C146119.3 (7)
C48—C43—P3123.4 (6)C150—C145—P8123.0 (6)
C44—C43—P3116.8 (6)C146—C145—P8117.6 (6)
C45—C44—C43119.6 (7)C147—C146—C145119.6 (9)
C45—C44—H44120.2C147—C146—H146120.2
C43—C44—H44120.2C145—C146—H146120.2
C46—C45—C44120.6 (8)C148—C147—C146117.3 (10)
C46—C45—H45119.7C148—C147—H147121.4
C44—C45—H45119.7C146—C147—H147121.4
C45—C46—C47119.2 (8)C147—C148—C149127.1 (10)
C45—C46—H46120.4C147—C148—H148116.5
C47—C46—H46120.4C149—C148—H148116.5
C46—C47—C48121.4 (8)C148—C149—C150115.2 (9)
C46—C47—H47119.3C148—C149—H149122.4
C48—C47—H47119.3C150—C149—H149122.4
C43—C48—C47119.8 (8)C145—C150—C149121.3 (8)
C43—C48—H48120.1C145—C150—H150119.4
C47—C48—H48120.1C149—C150—H150119.4
C50—C49—C54118.4 (8)C156—C151—C152116.9 (8)
C50—C49—P3118.0 (7)C156—C151—P8124.3 (6)
C54—C49—P3123.4 (7)C152—C151—P8118.6 (7)
C49—C50—C51120.7 (10)C153—C152—C151123.9 (10)
C49—C50—H50119.6C153—C152—H152118.0
C51—C50—H50119.6C151—C152—H152118.0
C52—C51—C50119.2 (12)C152—C153—C154117.9 (11)
C52—C51—H51120.4C152—C153—H153121.0
C50—C51—H51120.4C154—C153—H153121.0
C53—C52—C51121.6 (13)C153—C154—C155121.6 (12)
C53—C52—H52119.2C153—C154—H154119.2
C51—C52—H52119.2C155—C154—H154119.2
C52—C53—C54120.0 (12)C156—C155—C154117.9 (10)
C52—C53—H53120.0C156—C155—H155121.1
C54—C53—H53120.0C154—C155—H155121.1
C49—C54—C53120.1 (9)C151—C156—C155121.7 (9)
C49—C54—H54120.0C151—C156—H156119.1
C53—C54—H54120.0C155—C156—H156119.1
C60—C55—C56117.1 (7)C158—C157—C162119.6 (7)
C60—C55—P3119.6 (6)C158—C157—P8123.5 (6)
C56—C55—P3123.3 (6)C162—C157—P8116.8 (6)
C57—C56—C55119.5 (7)C157—C158—C159119.0 (8)
C57—C56—H56120.3C157—C158—H158120.5
C55—C56—H56120.3C159—C158—H158120.5
C58—C57—C56120.7 (9)C160—C159—C158122.1 (8)
C58—C57—H57119.7C160—C159—H159118.9
C56—C57—H57119.7C158—C159—H159118.9
C59—C58—C57121.3 (10)C161—C160—C159118.0 (8)
C59—C58—H58119.4C161—C160—H160121.0
C57—C58—H58119.4C159—C160—H160121.0
C58—C59—C60119.9 (9)C160—C161—C162121.4 (8)
C58—C59—H59120.0C160—C161—H161119.3
C60—C59—H59120.0C162—C161—H161119.3
C59—C60—C55121.4 (8)C157—C162—C161119.6 (7)
C59—C60—H60119.3C157—C162—H162120.2
C55—C60—H60119.3C161—C162—H162120.2
C62—C61—C66117.7 (6)C168—C163—C164117.4 (7)
C62—C61—P4125.0 (6)C168—C163—N4122.6 (7)
C66—C61—P4117.3 (6)C164—C163—N4120.0 (7)
C61—C62—C63121.6 (7)C165—C164—C163121.5 (8)
C61—C62—H62119.2C165—C164—H164119.2
C63—C62—H62119.2C163—C164—H164119.2
C64—C63—C62120.8 (8)C166—C165—C164119.9 (9)
C64—C63—H63119.6C166—C165—H165120.1
C62—C63—H63119.6C164—C165—H165120.1
C65—C64—C63118.5 (7)C165—C166—C167120.5 (8)
C65—C64—H64120.8C165—C166—Cl4118.9 (9)
C63—C64—H64120.8C167—C166—Cl4120.6 (8)
C64—C65—C66121.2 (8)C166—C167—C168120.5 (8)
C64—C65—H65119.4C166—C167—H167119.7
C66—C65—H65119.4C168—C167—H167119.7
C61—C66—C65120.3 (7)C163—C168—C167120.1 (7)
C61—C66—H66119.8C163—C168—S4118.7 (6)
C65—C66—H66119.8C167—C168—S4121.2 (6)
C68—C67—C72118.3 (8)C39—N1—Ag1111.1 (4)
C68—C67—P4120.1 (7)C39—N1—H1A114 (7)
C72—C67—P4121.5 (7)Ag1—N1—H1A111 (7)
C67—C68—C69122.7 (9)C39—N1—H1B111 (9)
C67—C68—H68118.6Ag1—N1—H1B104 (9)
C69—C68—H68118.6H1A—N1—H1B105 (10)
C70—C69—C68116.8 (11)C79—N2—Ag2108.2 (4)
C70—C69—H69121.6C79—N2—H2A114 (7)
C68—C69—H69121.6Ag2—N2—H2A104 (7)
C71—C70—C69122.4 (11)C79—N2—H2B110 (8)
C71—C70—H70118.8Ag2—N2—H2B115 (8)
C69—C70—H70118.8H2A—N2—H2B106 (6)
C70—C71—C72120.1 (11)C121—N3—Ag3109.6 (4)
C70—C71—H71119.9C121—N3—H3A109 (8)
C72—C71—H71119.9Ag3—N3—H3A106 (7)
C71—C72—C67119.7 (9)C121—N3—H3B110 (8)
C71—C72—H72120.2Ag3—N3—H3B109 (8)
C67—C72—H72120.2H3A—N3—H3B112 (9)
C74—C73—C78117.1 (7)C163—N4—Ag4114.2 (4)
C74—C73—P4118.5 (6)C163—N4—H4A119 (9)
C78—C73—P4124.1 (7)Ag4—N4—H4A100 (8)
C73—C74—C75121.5 (8)C163—N4—H4B108 (8)
C73—C74—H74119.3Ag4—N4—H4B106 (8)
C75—C74—H74119.3H4A—N4—H4B110 (10)
C76—C75—C74120.9 (10)C7—P1—C1105.7 (3)
C76—C75—H75119.5C7—P1—C13102.8 (3)
C74—C75—H75119.5C1—P1—C13104.6 (3)
C77—C76—C75117.1 (11)C7—P1—Ag1117.0 (2)
C77—C76—H76121.5C1—P1—Ag1113.9 (3)
C75—C76—H76121.5C13—P1—Ag1111.6 (2)
C76—C77—C78123.4 (10)C19—P2—C31105.6 (3)
C76—C77—H77118.3C19—P2—C25103.0 (4)
C78—C77—H77118.3C31—P2—C25104.9 (3)
C77—C78—C73119.8 (9)C19—P2—Ag1111.2 (2)
C77—C78—H78120.1C31—P2—Ag1112.3 (2)
C73—C78—H78120.1C25—P2—Ag1118.7 (2)
C84—C79—C80119.2 (7)C55—P3—C49105.3 (4)
C84—C79—N2120.5 (6)C55—P3—C43105.5 (3)
C80—C79—N2120.2 (6)C49—P3—C43104.8 (3)
C81—C80—C79120.6 (7)C55—P3—Ag2113.6 (2)
C81—C80—H80119.7C49—P3—Ag2115.5 (3)
C79—C80—H80119.7C43—P3—Ag2111.3 (2)
C80—C81—C82118.4 (7)C73—P4—C67105.6 (3)
C80—C81—H81120.8C73—P4—C61105.0 (3)
C82—C81—H81120.8C67—P4—C61103.4 (3)
C83—C82—C81122.7 (8)C73—P4—Ag2113.7 (2)
C83—C82—Cl2120.0 (7)C67—P4—Ag2115.0 (3)
C81—C82—Cl2117.1 (7)C61—P4—Ag2113.1 (2)
C82—C83—C84117.7 (7)C85—P5—C91106.7 (4)
C82—C83—H83121.1C85—P5—C97103.6 (4)
C84—C83—H83121.1C91—P5—C97103.3 (3)
C79—C84—C83121.3 (6)C85—P5—Ag3119.6 (2)
C79—C84—S2120.5 (5)C91—P5—Ag3109.0 (3)
C83—C84—S2118.2 (5)C97—P5—Ag3113.2 (2)
C90—C85—C86117.4 (7)C103—P6—C109105.9 (3)
C90—C85—P5117.9 (6)C103—P6—C115102.4 (3)
C86—C85—P5124.6 (7)C109—P6—C115104.2 (3)
C87—C86—C85120.5 (8)C103—P6—Ag3116.1 (2)
C87—C86—H86119.8C109—P6—Ag3109.7 (2)
C85—C86—H86119.8C115—P6—Ag3117.3 (2)
C88—C87—C86120.6 (9)C139—P7—C127104.5 (3)
C88—C87—H87119.7C139—P7—C133107.4 (3)
C86—C87—H87119.7C127—P7—C133103.7 (3)
C87—C88—C89119.6 (10)C139—P7—Ag4114.8 (2)
C87—C88—H88120.2C127—P7—Ag4111.1 (2)
C89—C88—H88120.2C133—P7—Ag4114.4 (2)
C88—C89—C90120.4 (9)C151—P8—C145104.5 (4)
C88—C89—H89119.8C151—P8—C157102.7 (3)
C90—C89—H89119.8C145—P8—C157103.2 (3)
C85—C90—C89121.4 (8)C151—P8—Ag4116.1 (3)
C85—C90—H90119.3C145—P8—Ag4114.7 (2)
C89—C90—H90119.3C157—P8—Ag4114.1 (2)
C96—C91—C92118.0 (8)O1—S1—O2113.5 (3)
C96—C91—P5119.1 (7)O1—S1—O3113.4 (3)
C92—C91—P5122.9 (6)O2—S1—O3110.9 (3)
C93—C92—C91120.8 (9)O1—S1—C38107.1 (3)
C93—C92—H92119.6O2—S1—C38106.8 (3)
C91—C92—H92119.6O3—S1—C38104.4 (3)
C94—C93—C92120.7 (11)O6—S2—O5112.9 (3)
C94—C93—H93119.6O6—S2—O4113.5 (3)
C92—C93—H93119.6O5—S2—O4112.4 (3)
C95—C94—C93118.5 (13)O6—S2—C84107.6 (3)
C95—C94—H94120.7O5—S2—C84103.6 (3)
C93—C94—H94120.7O4—S2—C84106.0 (3)
C94—C95—C96122.7 (12)O8—S3—O7113.4 (3)
C94—C95—H95118.6O8—S3—O9113.5 (3)
C96—C95—H95118.6O7—S3—O9111.6 (3)
C91—C96—C95119.1 (9)O8—S3—C122107.6 (3)
C91—C96—H96120.5O7—S3—C122106.1 (3)
C95—C96—H96120.5O9—S3—C122103.7 (3)
C98—C97—C102118.9 (7)O11—S4—O10114.2 (3)
C98—C97—P5118.4 (6)O11—S4—O12113.0 (3)
C102—C97—P5122.7 (6)O10—S4—O12111.2 (3)
C97—C98—C99121.6 (8)O11—S4—C168107.7 (4)
C97—C98—H98119.2O10—S4—C168106.0 (3)
C99—C98—H98119.2O12—S4—C168104.1 (3)
C6—C1—C2—C3−0.1 (12)C164—C163—C168—C167−0.3 (10)
P1—C1—C2—C3179.2 (6)N4—C163—C168—C167178.9 (6)
C1—C2—C3—C41.9 (13)C164—C163—C168—S4−179.4 (5)
C2—C3—C4—C5−2.8 (15)N4—C163—C168—S4−0.2 (9)
C3—C4—C5—C61.8 (16)C166—C167—C168—C163−1.1 (11)
C4—C5—C6—C10.2 (14)C166—C167—C168—S4177.9 (6)
C2—C1—C6—C5−1.0 (12)C38—C39—N1—Ag180.8 (7)
P1—C1—C6—C5179.6 (6)C40—C39—N1—Ag1−95.9 (7)
C12—C7—C8—C91.0 (10)P2—Ag1—N1—C39−157.0 (4)
P1—C7—C8—C9175.8 (6)P1—Ag1—N1—C3934.7 (5)
C7—C8—C9—C100.3 (12)C84—C79—N2—Ag285.6 (6)
C8—C9—C10—C11−2.4 (13)C80—C79—N2—Ag2−90.2 (6)
C9—C10—C11—C123.2 (14)P4—Ag2—N2—C79−151.6 (4)
C10—C11—C12—C7−1.8 (13)P3—Ag2—N2—C7930.3 (5)
C8—C7—C12—C11−0.3 (10)C126—C121—N3—Ag3−88.6 (6)
P1—C7—C12—C11−175.1 (6)C122—C121—N3—Ag390.0 (6)
C18—C13—C14—C150.3 (11)P6—Ag3—N3—C121−145.2 (4)
P1—C13—C14—C15177.5 (6)P5—Ag3—N3—C12131.5 (5)
C13—C14—C15—C16−2.9 (13)C168—C163—N4—Ag4−92.1 (7)
C14—C15—C16—C174.8 (14)C164—C163—N4—Ag487.1 (7)
C15—C16—C17—C18−4.2 (13)P8—Ag4—N4—C163153.6 (5)
C14—C13—C18—C170.3 (11)P7—Ag4—N4—C163−24.3 (6)
P1—C13—C18—C17−177.1 (6)C12—C7—P1—C1−115.3 (6)
C16—C17—C18—C131.7 (12)C8—C7—P1—C170.1 (6)
C24—C19—C20—C211.5 (11)C12—C7—P1—C13135.3 (6)
P2—C19—C20—C21−175.9 (6)C8—C7—P1—C13−39.3 (6)
C19—C20—C21—C220.3 (13)C12—C7—P1—Ag112.8 (6)
C20—C21—C22—C23−3.2 (14)C8—C7—P1—Ag1−161.8 (5)
C21—C22—C23—C244.2 (14)C2—C1—P1—C7−7.4 (8)
C22—C23—C24—C19−2.5 (13)C6—C1—P1—C7171.9 (5)
C20—C19—C24—C23−0.4 (10)C2—C1—P1—C13100.7 (7)
P2—C19—C24—C23176.9 (6)C6—C1—P1—C13−80.0 (6)
C30—C25—C26—C272.0 (13)C2—C1—P1—Ag1−137.2 (6)
P2—C25—C26—C27−177.3 (6)C6—C1—P1—Ag142.1 (6)
C25—C26—C27—C28−4.0 (15)C18—C13—P1—C7−59.5 (6)
C26—C27—C28—C295.0 (18)C14—C13—P1—C7123.2 (6)
C27—C28—C29—C30−4.3 (19)C18—C13—P1—C1−169.7 (6)
C26—C25—C30—C29−1.0 (13)C14—C13—P1—C113.0 (7)
P2—C25—C30—C29178.3 (7)C18—C13—P1—Ag166.6 (6)
C28—C29—C30—C252.1 (16)C14—C13—P1—Ag1−110.7 (6)
C36—C31—C32—C33−0.2 (11)N1—Ag1—P1—C7−94.2 (3)
P2—C31—C32—C33−178.0 (5)P2—Ag1—P1—C797.7 (3)
C31—C32—C33—C34−1.0 (12)N1—Ag1—P1—C129.7 (3)
C32—C33—C34—C351.8 (13)P2—Ag1—P1—C1−138.4 (3)
C33—C34—C35—C36−1.2 (14)N1—Ag1—P1—C13147.9 (3)
C34—C35—C36—C31−0.1 (13)P2—Ag1—P1—C13−20.2 (3)
C32—C31—C36—C350.8 (11)C20—C19—P2—C31−162.8 (5)
P2—C31—C36—C35178.7 (6)C24—C19—P2—C3120.0 (7)
C42—C37—C38—C392.0 (12)C20—C19—P2—C2587.4 (6)
C42—C37—C38—S1−175.5 (6)C24—C19—P2—C25−89.8 (6)
C37—C38—C39—N1−178.3 (6)C20—C19—P2—Ag1−40.7 (6)
S1—C38—C39—N1−0.7 (9)C24—C19—P2—Ag1142.0 (5)
C37—C38—C39—C40−1.5 (10)C32—C31—P2—C19−104.4 (6)
S1—C38—C39—C40176.0 (5)C36—C31—P2—C1977.9 (6)
C38—C39—C40—C411.5 (11)C32—C31—P2—C254.0 (7)
N1—C39—C40—C41178.3 (7)C36—C31—P2—C25−173.8 (6)
C39—C40—C41—C42−2.0 (14)C32—C31—P2—Ag1134.3 (6)
C40—C41—C42—C372.4 (14)C36—C31—P2—Ag1−43.5 (6)
C40—C41—C42—Cl1179.6 (7)C30—C25—P2—C19−174.8 (7)
C38—C37—C42—C41−2.4 (13)C26—C25—P2—C194.5 (8)
C38—C37—C42—Cl1−179.6 (6)C30—C25—P2—C3174.9 (7)
C48—C43—C44—C451.6 (12)C26—C25—P2—C31−105.8 (7)
P3—C43—C44—C45−173.1 (6)C30—C25—P2—Ag1−51.5 (8)
C43—C44—C45—C46−0.2 (12)C26—C25—P2—Ag1127.8 (6)
C44—C45—C46—C47−0.4 (14)N1—Ag1—P2—C19144.6 (3)
C45—C46—C47—C48−0.4 (15)P1—Ag1—P2—C19−46.9 (3)
C44—C43—C48—C47−2.4 (13)N1—Ag1—P2—C31−97.3 (3)
P3—C43—C48—C47172.0 (7)P1—Ag1—P2—C3171.2 (3)
C46—C47—C48—C431.8 (15)N1—Ag1—P2—C2525.5 (4)
C54—C49—C50—C51−0.3 (11)P1—Ag1—P2—C25−166.0 (3)
P3—C49—C50—C51−175.5 (6)C60—C55—P3—C49−101.4 (6)
C49—C50—C51—C52−0.3 (13)C56—C55—P3—C4979.0 (6)
C50—C51—C52—C530.3 (17)C60—C55—P3—C43148.0 (6)
C51—C52—C53—C540.5 (17)C56—C55—P3—C43−31.6 (7)
C50—C49—C54—C531.1 (11)C60—C55—P3—Ag225.9 (6)
P3—C49—C54—C53176.0 (6)C56—C55—P3—Ag2−153.7 (5)
C52—C53—C54—C49−1.2 (14)C50—C49—P3—C55157.5 (6)
C60—C55—C56—C571.6 (12)C54—C49—P3—C55−17.4 (7)
P3—C55—C56—C57−178.7 (7)C50—C49—P3—C43−91.5 (6)
C55—C56—C57—C58−0.2 (15)C54—C49—P3—C4393.6 (7)
C56—C57—C58—C59−1.7 (17)C50—C49—P3—Ag231.4 (6)
C57—C58—C59—C602.2 (18)C54—C49—P3—Ag2−143.5 (6)
C58—C59—C60—C55−0.7 (16)C48—C43—P3—C55131.8 (7)
C56—C55—C60—C59−1.2 (12)C44—C43—P3—C55−53.7 (6)
P3—C55—C60—C59179.2 (8)C48—C43—P3—C4920.9 (8)
C66—C61—C62—C630.1 (14)C44—C43—P3—C49−164.6 (6)
P4—C61—C62—C63179.3 (7)C48—C43—P3—Ag2−104.6 (7)
C61—C62—C63—C64−0.1 (15)C44—C43—P3—Ag269.9 (6)
C62—C63—C64—C65−0.5 (15)N2—Ag2—P3—C55−86.6 (3)
C63—C64—C65—C661.0 (14)P4—Ag2—P3—C5595.7 (2)
C62—C61—C66—C650.4 (12)N2—Ag2—P3—C4935.2 (3)
P4—C61—C66—C65−178.9 (6)P4—Ag2—P3—C49−142.5 (3)
C64—C65—C66—C61−1.0 (13)N2—Ag2—P3—C43154.6 (3)
C72—C67—C68—C69−1.7 (11)P4—Ag2—P3—C43−23.1 (3)
P4—C67—C68—C69−179.5 (6)C74—C73—P4—C67176.5 (6)
C67—C68—C69—C701.9 (12)C78—C73—P4—C67−9.8 (7)
C68—C69—C70—C71−0.6 (15)C74—C73—P4—C6167.6 (6)
C69—C70—C71—C72−0.8 (16)C78—C73—P4—C61−118.7 (6)
C70—C71—C72—C671.0 (14)C74—C73—P4—Ag2−56.5 (6)
C68—C67—C72—C710.2 (11)C78—C73—P4—Ag2117.2 (6)
P4—C67—C72—C71178.0 (6)C68—C67—P4—C73111.4 (6)
C78—C73—C74—C753.4 (11)C72—C67—P4—C73−66.3 (6)
P4—C73—C74—C75177.5 (6)C68—C67—P4—C61−138.5 (6)
C73—C74—C75—C76−0.1 (13)C72—C67—P4—C6143.7 (6)
C74—C75—C76—C77−2.6 (14)C68—C67—P4—Ag2−14.8 (6)
C75—C76—C77—C781.8 (15)C72—C67—P4—Ag2167.5 (5)
C76—C77—C78—C731.6 (14)C62—C61—P4—C735.6 (8)
C74—C73—C78—C77−4.1 (11)C66—C61—P4—C73−175.2 (6)
P4—C73—C78—C77−177.9 (6)C62—C61—P4—C67−104.9 (8)
C84—C79—C80—C810.1 (10)C66—C61—P4—C6774.3 (6)
N2—C79—C80—C81176.0 (6)C62—C61—P4—Ag2130.1 (7)
C79—C80—C81—C82−1.0 (11)C66—C61—P4—Ag2−50.7 (6)
C80—C81—C82—C832.6 (12)N2—Ag2—P4—C733.0 (3)
C80—C81—C82—Cl2177.6 (5)P3—Ag2—P4—C73−179.2 (3)
C81—C82—C83—C84−3.2 (12)N2—Ag2—P4—C67124.9 (3)
Cl2—C82—C83—C84−178.0 (5)P3—Ag2—P4—C67−57.3 (2)
C80—C79—C84—C83−0.7 (10)N2—Ag2—P4—C61−116.6 (3)
N2—C79—C84—C83−176.6 (6)P3—Ag2—P4—C6161.2 (3)
C80—C79—C84—S2177.2 (5)C90—C85—P5—C91171.1 (6)
N2—C79—C84—S21.3 (9)C86—C85—P5—C91−11.0 (7)
C82—C83—C84—C792.2 (10)C90—C85—P5—C97−80.3 (6)
C82—C83—C84—S2−175.8 (5)C86—C85—P5—C9797.7 (6)
C90—C85—C86—C87−0.6 (11)C90—C85—P5—Ag346.9 (6)
P5—C85—C86—C87−178.5 (6)C86—C85—P5—Ag3−135.1 (5)
C85—C86—C87—C88−1.0 (14)C96—C91—P5—C85−95.5 (7)
C86—C87—C88—C892.9 (15)C92—C91—P5—C8588.0 (7)
C87—C88—C89—C90−3.1 (14)C96—C91—P5—C97155.7 (7)
C86—C85—C90—C890.3 (11)C92—C91—P5—C97−20.8 (8)
P5—C85—C90—C89178.4 (6)C96—C91—P5—Ag335.0 (7)
C88—C89—C90—C851.6 (12)C92—C91—P5—Ag3−141.5 (7)
C96—C91—C92—C930.3 (14)C98—C97—P5—C85163.6 (6)
P5—C91—C92—C93176.9 (8)C102—C97—P5—C85−15.2 (7)
C91—C92—C93—C94−3.8 (18)C98—C97—P5—C91−85.3 (7)
C92—C93—C94—C955(2)C102—C97—P5—C9196.0 (7)
C93—C94—C95—C96−3(2)C98—C97—P5—Ag332.5 (7)
C92—C91—C96—C951.9 (14)C102—C97—P5—Ag3−146.2 (6)
P5—C91—C96—C95−174.8 (8)N3—Ag3—P5—C8522.7 (3)
C94—C95—C96—C91−0.8 (19)P6—Ag3—P5—C85−160.8 (3)
C102—C97—C98—C99−3.6 (13)N3—Ag3—P5—C91−100.4 (3)
P5—C97—C98—C99177.7 (7)P6—Ag3—P5—C9176.1 (3)
C97—C98—C99—C1004.6 (15)N3—Ag3—P5—C97145.2 (3)
C98—C99—C100—C101−4.6 (15)P6—Ag3—P5—C97−38.3 (3)
C99—C100—C101—C1023.7 (14)C104—C103—P6—C10966.0 (7)
C98—C97—C102—C1012.5 (12)C108—C103—P6—C109−113.9 (6)
P5—C97—C102—C101−178.7 (6)C104—C103—P6—C115−42.9 (7)
C100—C101—C102—C97−2.6 (13)C108—C103—P6—C115137.2 (6)
C108—C103—C104—C105−1.5 (12)C104—C103—P6—Ag3−172.0 (5)
P6—C103—C104—C105178.6 (6)C108—C103—P6—Ag38.1 (7)
C103—C104—C105—C1063.0 (14)C114—C109—P6—C103−5.6 (7)
C104—C105—C106—C107−4.1 (16)C110—C109—P6—C103170.2 (5)
C105—C106—C107—C1083.9 (17)C114—C109—P6—C115102.0 (7)
C106—C107—C108—C103−2.5 (15)C110—C109—P6—C115−82.1 (6)
C104—C103—C108—C1071.3 (12)C114—C109—P6—Ag3−131.7 (6)
P6—C103—C108—C107−178.8 (7)C110—C109—P6—Ag344.2 (6)
C114—C109—C110—C111−2.7 (11)C116—C115—P6—C103−75.2 (6)
P6—C109—C110—C111−179.0 (6)C120—C115—P6—C103103.9 (6)
C109—C110—C111—C1121.6 (12)C116—C115—P6—C109174.6 (6)
C110—C111—C112—C113−2.4 (13)C120—C115—P6—C109−6.3 (7)
C111—C112—C113—C1144.3 (12)C116—C115—P6—Ag353.2 (6)
C110—C109—C114—C1134.6 (11)C120—C115—P6—Ag3−127.7 (6)
P6—C109—C114—C113−179.6 (6)N3—Ag3—P6—C103118.6 (3)
C112—C113—C114—C109−5.5 (12)P5—Ag3—P6—C103−58.0 (3)
C120—C115—C116—C117−3.2 (12)N3—Ag3—P6—C109−121.5 (3)
P6—C115—C116—C117175.9 (6)P5—Ag3—P6—C10962.0 (2)
C115—C116—C117—C1183.9 (13)N3—Ag3—P6—C115−2.9 (3)
C116—C117—C118—C119−2.2 (14)P5—Ag3—P6—C115−179.5 (2)
C117—C118—C119—C120−0.1 (13)C140—C139—P7—C127−92.2 (7)
C116—C115—C120—C1191.0 (11)C144—C139—P7—C12791.5 (6)
P6—C115—C120—C119−178.1 (6)C140—C139—P7—C13317.4 (7)
C118—C119—C120—C1150.6 (13)C144—C139—P7—C133−158.8 (6)
C126—C121—C122—C123−1.1 (10)C140—C139—P7—Ag4145.9 (6)
N3—C121—C122—C123−179.8 (5)C144—C139—P7—Ag4−30.4 (6)
C126—C121—C122—S3177.9 (5)C132—C127—P7—C139−29.1 (7)
N3—C121—C122—S3−0.7 (8)C128—C127—P7—C139158.2 (6)
C121—C122—C123—C124−0.8 (10)C132—C127—P7—C133−141.4 (6)
S3—C122—C123—C124−179.9 (5)C128—C127—P7—C13345.9 (6)
C122—C123—C124—C1253.3 (11)C132—C127—P7—Ag495.3 (6)
C122—C123—C124—Cl3−179.5 (4)C128—C127—P7—Ag4−77.5 (6)
C123—C124—C125—C126−3.7 (11)C138—C133—P7—C139110.2 (6)
Cl3—C124—C125—C126179.1 (5)C134—C133—P7—C139−72.1 (7)
C122—C121—C126—C1250.7 (10)C138—C133—P7—C127−139.6 (6)
N3—C121—C126—C125179.4 (5)C134—C133—P7—C12738.1 (7)
C124—C125—C126—C1211.7 (10)C138—C133—P7—Ag4−18.4 (7)
C132—C127—C128—C1290.9 (11)C134—C133—P7—Ag4159.2 (5)
P7—C127—C128—C129174.0 (6)N4—Ag4—P7—C139−38.3 (3)
C127—C128—C129—C130−0.9 (12)P8—Ag4—P7—C139143.9 (3)
C128—C129—C130—C1310.1 (13)N4—Ag4—P7—C127−156.5 (3)
C129—C130—C131—C1320.5 (13)P8—Ag4—P7—C12725.7 (3)
C128—C127—C132—C131−0.2 (12)N4—Ag4—P7—C13386.6 (3)
P7—C127—C132—C131−173.0 (6)P8—Ag4—P7—C133−91.3 (2)
C130—C131—C132—C127−0.5 (13)C156—C151—P8—C14571.8 (7)
C138—C133—C134—C1352.9 (11)C152—C151—P8—C145−103.3 (6)
P7—C133—C134—C135−174.8 (6)C156—C151—P8—C157−35.7 (7)
C133—C134—C135—C136−4.7 (13)C152—C151—P8—C157149.2 (6)
C134—C135—C136—C1375.6 (14)C156—C151—P8—Ag4−160.8 (6)
C135—C136—C137—C138−4.7 (15)C152—C151—P8—Ag424.0 (6)
C134—C133—C138—C137−2.1 (12)C150—C145—P8—C151−4.3 (7)
P7—C133—C138—C137175.7 (6)C146—C145—P8—C151172.5 (5)
C136—C137—C138—C1333.0 (13)C150—C145—P8—C157102.8 (6)
C144—C139—C140—C141−1.2 (11)C146—C145—P8—C157−80.4 (6)
P7—C139—C140—C141−177.5 (6)C150—C145—P8—Ag4−132.5 (5)
C139—C140—C141—C1420.9 (13)C146—C145—P8—Ag444.2 (6)
C140—C141—C142—C143−1.1 (14)C158—C157—P8—C151121.1 (7)
C141—C142—C143—C1441.7 (14)C162—C157—P8—C151−56.3 (7)
C142—C143—C144—C139−2.0 (13)C158—C157—P8—C14512.6 (8)
C140—C139—C144—C1431.8 (12)C162—C157—P8—C145−164.8 (6)
P7—C139—C144—C143178.3 (6)C158—C157—P8—Ag4−112.4 (7)
C150—C145—C146—C147−5.1 (11)C162—C157—P8—Ag470.2 (7)
P8—C145—C146—C147178.0 (6)N4—Ag4—P8—C151−124.4 (3)
C145—C146—C147—C1481.9 (13)P7—Ag4—P8—C15153.5 (3)
C146—C147—C148—C1493.0 (17)N4—Ag4—P8—C145−2.2 (3)
C147—C148—C149—C150−4.3 (16)P7—Ag4—P8—C145175.6 (3)
C146—C145—C150—C1493.8 (11)N4—Ag4—P8—C157116.5 (3)
P8—C145—C150—C149−179.5 (5)P7—Ag4—P8—C157−65.7 (3)
C148—C149—C150—C1450.7 (12)C37—C38—S1—O1−10.1 (7)
C156—C151—C152—C1531.5 (12)C39—C38—S1—O1172.4 (5)
P8—C151—C152—C153177.0 (7)C37—C38—S1—O2−132.0 (6)
C151—C152—C153—C154−2.0 (14)C39—C38—S1—O250.4 (6)
C152—C153—C154—C1550.7 (16)C37—C38—S1—O3110.4 (6)
C153—C154—C155—C1560.9 (15)C39—C38—S1—O3−67.2 (6)
C152—C151—C156—C1550.2 (11)C79—C84—S2—O6170.0 (5)
P8—C151—C156—C155−175.0 (6)C83—C84—S2—O6−12.0 (6)
C154—C155—C156—C151−1.3 (13)C79—C84—S2—O5−70.3 (6)
C162—C157—C158—C159−2.3 (13)C83—C84—S2—O5107.7 (5)
P8—C157—C158—C159−179.6 (7)C79—C84—S2—O448.2 (6)
C157—C158—C159—C1604.0 (15)C83—C84—S2—O4−133.8 (5)
C158—C159—C160—C161−5.7 (15)C121—C122—S3—O8172.1 (5)
C159—C160—C161—C1625.7 (15)C123—C122—S3—O8−8.9 (6)
C158—C157—C162—C1612.4 (13)C121—C122—S3—O750.3 (6)
P8—C157—C162—C161179.8 (7)C123—C122—S3—O7−130.6 (5)
C160—C161—C162—C157−4.2 (14)C121—C122—S3—O9−67.4 (6)
C168—C163—C164—C1652.6 (10)C123—C122—S3—O9111.6 (5)
N4—C163—C164—C165−176.7 (6)C163—C168—S4—O11−173.1 (5)
C163—C164—C165—C166−3.4 (11)C167—C168—S4—O117.9 (6)
C164—C165—C166—C1671.8 (12)C163—C168—S4—O10−50.5 (6)
C164—C165—C166—Cl4−177.1 (5)C167—C168—S4—O10130.4 (6)
C165—C166—C167—C1680.4 (13)C163—C168—S4—O1266.8 (6)
Cl4—C166—C167—C168179.3 (5)C167—C168—S4—O12−112.2 (6)

Hydrogen-bond geometry (Å, °)

D—H···AD—HH···AD···AD—H···A
N1—H1B···O20.82 (5)2.21 (9)2.879 (7)139 (11)
N1—H1A···O9i0.90 (5)2.08 (5)2.976 (8)174 (10)
N2—H2B···O40.82 (4)2.21 (7)2.870 (7)139 (10)
N2—H2A···O11ii0.89 (4)2.56 (8)3.235 (8)134 (9)
N2—H2A···O12ii0.89 (4)2.05 (5)2.916 (8)164 (10)
N3—H3A···O50.88 (5)2.12 (5)2.991 (7)175 (11)
N3—H3B···O70.86 (5)2.18 (8)2.900 (7)141 (10)
N4—H4A···O1iii0.81 (5)2.51 (9)3.148 (8)136 (10)
N4—H4A···O3iii0.81 (5)2.26 (6)3.027 (8)159 (11)
N4—H4B···O100.85 (5)2.13 (8)2.877 (8)146 (11)

Symmetry codes: (i) x, y, z+1; (ii) −x+1, −y+1, −z+1; (iii) −x, −y+1, −z+1.

Footnotes

Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: CI2554).

References

  • Dong, X.-W., Wu, F.-Y. & Li, Y.-J. (2007). Acta Cryst. E63, m2885.
  • Higashi, T. (1995). ABSCOR Rigaku Corporation, Tokyo, Japan.
  • Rigaku (1998). PROCESS-AUTO Rigaku Corporation, Tokyo, Japan.
  • Sheldrick, G. M. (2008). Acta Cryst. A64, 112–122. [PubMed]

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