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Acta Crystallogr Sect E Struct Rep Online. Oct 1, 2012; 68(Pt 10): m1313–m1314.
Published online Sep 29, 2012. doi:  10.1107/S1600536812040652
PMCID: PMC3470180
Tris(η5-cyclo­penta­dien­yl)-tris­[η6-[9,10-dihydro­anthracene-9,10-endo-3′,4′-(N-benz­yl)pyrrolidine]]triruthenium(II) tris­(hexa­fluoro­phosphate) acetone disolvate
Ielyzaveta Bratko,a Sonia Mallet-Ladeira,b Nathalie Saffon,b Emmanuelle Teuma,a and Montserrat Gómeza*
aLaboratoire Hétérochimie Fondamentale et Appliquée, UMR CNRS 5069, Université Paul Sabatier, 118 route de Narbonne, 31062 Toulouse Cedex 9, France
bInstitut de Chimie de Toulouse FR2599, UPS, Université de Toulouse, 118 route de Narbonne, 31062 Toulouse cedex 9, France
Correspondence e-mail: gomez/at/chimie.ups-tlse.fr
Received September 14, 2012; Accepted September 26, 2012.
In the title compound, [Ru3(C25H23N)(C5H5)3]·3PF6·2C3H6O], the cation is a triruthenium complex of a 9,10-dihydro­anthracene derivative. Three RuCp+ (Cp is cyclo­penta­dien­yl) groups are bonded to the three aromatic rings of the ligand. Surprisingly, the pyramidalized N atom of the heterocycle (Σ C—N—C = 329.0°) points towards the anthracenyl group, so losing its coordinative ability. There is an inter­molecular C—H(...)π inter­action involving an acetone mol­ecule and the adjacent benzyl ring of the ligand. In the crystal, mol­ecules are linked via a number of C—H(...)O and C—H(...)F inter­actions and a C—H(...)π inter­action, leading to the formation of a three-dimensional supra­molecular structure. One of the Cp groups is disordered over two positions, with refined occupancies of 0.695 (14):0.305 (14). Two of the three hexa­fluoro­phospate anions are disordered, with refined occupancies of 0.630 (6):0.370 (6) and 0.771 (8):0.229 (8). One of the two solvent acetone mol­ecules is also disordered, with refined occupancies of 0.82 (2):0.18 (2).
Related literature  
For the synthesis and crystal structure of the free ligand, see: Bratko et al. (2012 [triangle]). For the synthesis of related ligands, see: Sanhes et al. (2008 [triangle]). For the coordination chemistry of related compounds with 9,10-dihydro­anthracene backbones fused with pyrrolidine groups, see: Sanhes et al. (2009 [triangle], 2010 [triangle]).
An external file that holds a picture, illustration, etc.
Object name is e-68-m1313-scheme1.jpg Object name is e-68-m1313-scheme1.jpg
Crystal data  
  • [Ru3(C25H23N)(C5H5)3]·3PF6·2C3H6O]
  • M r = 1386.99
  • Monoclinic, An external file that holds a picture, illustration, etc.
Object name is e-68-m1313-efi1.jpg
  • a = 9.6054 (7) Å
  • b = 36.567 (2) Å
  • c = 14.4207 (10) Å
  • β = 105.038 (3)°
  • V = 4891.6 (6) Å3
  • Z = 4
  • Mo Kα radiation
  • μ = 1.12 mm−1
  • T = 193 K
  • 0.16 × 0.02 × 0.02 mm
Data collection  
  • Bruker Kappa APEXII CCD Quazar diffractometer
  • Absorption correction: multi-scan (SADABS; Bruker 2008 [triangle]) T min = 0.841, T max = 0.978
  • 75190 measured reflections
  • 11960 independent reflections
  • 7646 reflections with I > 2σ(I)
  • R int = 0.083
Refinement  
  • R[F 2 > 2σ(F 2)] = 0.047
  • wR(F 2) = 0.093
  • S = 1.01
  • 11960 reflections
  • 871 parameters
  • 738 restraints
  • H-atom parameters constrained
  • Δρmax = 0.70 e Å−3
  • Δρmin = −0.77 e Å−3
Data collection: APEX2 (Bruker, 2008 [triangle]); cell refinement: APEX2 and SAINT (Bruker, 2008 [triangle]); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 [triangle]); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 [triangle]); molecular graphics: SHELXTL (Sheldrick, 2008 [triangle]); software used to prepare material for publication: publCIF (Westrip, 2010 [triangle]).
Table 1
Table 1
Hydrogen-bond geometry (Å, °)
Supplementary Material
Crystal structure: contains datablock(s) I, global. DOI: 10.1107/S1600536812040652/su2499sup1.cif
Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536812040652/su2499Isup2.hkl
Additional supplementary materials: crystallographic information; 3D view; checkCIF report
Acknowledgments
This work was financially supported by the Centre National de la Recherche Scientifique (CNRS) and Université Paul Sabatier. IB is grateful to the Ministère de l’Enseignement Supérieur et de la Recherche for a PhD grant.
supplementary crystallographic information
Comment
In the last years, we have been interested in the design of new ligands for studying original ways to coordinate transition metals with the purpose of finding applications in homogeneous catalysis. Within this framework, we have explored the synthesis of original 9,10-dihydroanthracene backbones fused with pyrrolidine groups (Sanhes et al., 2008). They offer the possibility of coordinating to metal atoms through both the heterocyclic moiety (Sanhes et al., 2008, 2009, 2010) and the aromatic rings, leading to polymetallic systems potentially interesting for studying cooperative effects in catalysis. In contrast to the large number of works published concerning the π-coordination chemistry of anthracene and also 9,10-dihydroanthracene derivatives, no studies have been reported in relation to the π-interactions of Diels–Alder adducts involving anthracene with transition metals.
Our aim is to study the coordination chemistry of the new ligand 9,10-dihydroanthracene-9,10-endo-3',4'-(N-benzyl)pyrrolidine (Bratko et al., 2012), through π-interactions with metal fragments. Ruthenium(II) organometallic precursors containing the RuCp+ moiety were chosen because of its known ability to give metal–arene complexes. Herein, we describe the crystal structure of, to the best of your knowledge, the first tris-ruthenium(II) complex of this kind of ligands.
The molecular structure of the title trinuclear ruthenium(II) cation is shown in Fig. 1. The asymmetric unit contains a tris(η5-cyclopentadienyl)-[(tris-η6)-(9,10-dihydroanthracene-9,10-endo-3',4'-(N-benzyl)-pyrrolidine)]-triruthenium(II) cation, three hexafluorophosphate anions and two molecules of acetone. In the cation, the N atom of the heterocycle is pyramidalized (Σ C—N—C = 328.95°), and points towards the anthracenyl group. This is in contrast to the situation in the free ligand (Bratko et al., 2012), where the N atom is involved in a C—H···N interaction with the chloroform solvent molecule. In both compounds the pyrrolidine ring has an envelope conformation with the N atom as the flap. A weak intramolecular interaction between one H of the benzyl group (C21-H) and one of the aromatic rings of the backbone is observed (Fig. 1), favoured by the electron-deficient aromatic group of the 9,10-dihydroanthracenyl moiety upon ruthenium coordination. The deviation of atom N1 from the four planar atoms of the heterocycle in the ligand is 0.631 (1) Å, compared to 0.562 (3) Å in the title cation. There is a C—H···π interaction involving an acetone molecule and the adjacent benzyl ring of the ligand (Table 1).
In the crystal, molecules are linked via a second C—H···π interaction, leading to the formation of an inversion dimer (Table 1 and Fig. 2). There are also a number of C—H···O and C—H···F interactions present, resulting finally in the formation of a three-dimensional supramolecular structure (Table 1).
Experimental
The trinuclear complex was prepared by adding [RuCp(CH3CN)3]PF6 (38.6 mg, 0.09 mmol) to a degassed solution of the ligand 9,10-dihydroanthracene-9,10-endo-3',4'-(N-benzyl)-pyrrolidine (10 mg, 0.03 mmol) in 8 ml of 1,2-dichloroethane. The resultant solution was then refluxed overnight. The reaction mixture was cooled and the solvent evaporated under vacuum. Single crystals were obtained from an acetone solution of the isolated complex at room temperature. The complex was characterized by high-resolution mass spectrometry (ES+, methanol): calc. mass for [C40H38NRu3.2PF6]+ 1126.9451; found: 1126.9471. Further spectroscopic data for the title compound are available in the archived CIF.
Refinement
One of the cyclopentadyenyl groups (C36–C40/C36'–C40') is disordered over two positions with refined occupancies of 0.695 (14):0.305 (14). Two of the three hexafluorophospate anions (involving atoms P1 and P3) are disordered with refined occupancies of 0.630 (6):0.370 (6) and 0.771 (8):0.229 (8), respectively. One of the two molecules of solvent is also disordered with refined occupancies of 0.82 (2):0.18 (2). The SAME, DELU and SIMU restraints were applied for all of the disordered atoms (Sheldrick, 2008). All the H atoms were included in calulated positions and treated as riding: C—H = 0.95 Å (CH-aromatic), 0.98 Å (CH3), 0.99 Å (CH2) and 1.0 Å (CH-methine), with Uiso(H) = 1.5Ueq(C) for methyl H atoms and = 1.2Ueq(C) for other H atoms.
Figures
Fig. 1.
Fig. 1.
A view of the molecular structure of the title complex, with the atom numbering. Displacement ellipsoids are drawn at the 50% probability level. The three PF6- anions, the acteone solvent molecules, the minor fragments of the disordered atoms and the (more ...)
Fig. 2.
Fig. 2.
View showing the formation of the inversion dimer resulting from intermolecular C—H···π interactions, shown as dashed lines. [Symmetry code: (i) -x, 1 - y, 1 - z].
Crystal data
[Ru3(C25H23N)(C5H5)3]·3PF6·2C3H6O]F(000) = 2752
Mr = 1386.99Dx = 1.883 Mg m3
Monoclinic, P21/nMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ynCell parameters from 9276 reflections
a = 9.6054 (7) Åθ = 2.5–23.9°
b = 36.567 (2) ŵ = 1.12 mm1
c = 14.4207 (10) ÅT = 193 K
β = 105.038 (3)°Needle, colourless
V = 4891.6 (6) Å30.16 × 0.02 × 0.02 mm
Z = 4
Data collection
Bruker Kappa APEXII CCD Quazar diffractometer11960 independent reflections
Radiation source: fine-focus sealed tube7646 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.083
[var phi] and ω scansθmax = 28.3°, θmin = 2.7°
Absorption correction: multi-scan (SADABS; Bruker 2008)h = −12→12
Tmin = 0.841, Tmax = 0.978k = −46→48
75190 measured reflectionsl = −18→19
Refinement
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.047Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.093H-atom parameters constrained
S = 1.01w = 1/[σ2(Fo2) + (0.0298P)2 + 6.328P] where P = (Fo2 + 2Fc2)/3
11960 reflections(Δ/σ)max = 0.002
871 parametersΔρmax = 0.70 e Å3
738 restraintsΔρmin = −0.77 e Å3
Special details
Experimental. Spectroscopic data for the title compound: 1H NMR (300 MHz in (CD3)2CO): 6.68–6.70 (m, 2H, Harom); 6.56–6.58 (m, 2H, Harom); 6.35–6.37 (m, 2H, Harom); 6.30–6.31 (m, 3H, Harom of Bn); 6.23–6.26 (m, 2H, Harom); 6.00–6.03 (m, 2H, Harom); 5.67 (m, 5H, Cp); 5.43 (s, 5H,Cp); 4.91 (s, 5H, Cp); 4.31 (m, 2H, H9,10); 3.16 (s, 2H, H19); 3.08–3.10 (m, 2H, H17 or H18); 2.78–2.84 (m, 2H, H15+16); 2.49–2.54 (m, 2H, H17 or H18). 13C NMR (75 MHz in (CD3)2CO): 115.3, 107.0 (C11,12,13,14); 87.5 (CHarom); 87.3 (CH of Bn); 87.1, 85.9, 84.9, 84.7 (CH arom); 83.2 (Cp); 82.5(Cp); 82.3 (Cp); 58.7 (C19); 58.5 (C17,18); 48.2 (C15,16); 44.3(C9,10).
Geometry. Bond distances, angles etc. have been calculated using the rounded fractional coordinates. All su's are estimated from the variances of the (full) variance-covariance matrix. The cell esds are taken into account in the estimation of distances, angles and torsion angles
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*/UeqOcc. (<1)
Ru10.33854 (4)0.42603 (1)0.72728 (2)0.0236 (1)
Ru20.16059 (4)0.45640 (1)0.22459 (2)0.0216 (1)
Ru30.10104 (4)0.31457 (1)0.07175 (3)0.0299 (1)
N10.2080 (4)0.36051 (9)0.4696 (2)0.0237 (11)
C1−0.0441 (5)0.36216 (11)0.0595 (3)0.0320 (16)
C20.0094 (6)0.35921 (12)−0.0230 (3)0.0376 (16)
C30.1566 (6)0.35806 (12)−0.0146 (3)0.0389 (19)
C40.2558 (5)0.35895 (11)0.0760 (3)0.0291 (14)
C50.3412 (4)0.43265 (10)0.3366 (3)0.0219 (12)
C60.2829 (5)0.46293 (11)0.3753 (3)0.0266 (14)
C70.1353 (5)0.46418 (11)0.3708 (3)0.0272 (14)
C80.0416 (5)0.43567 (10)0.3259 (3)0.0222 (12)
C90.0203 (4)0.37137 (10)0.2446 (3)0.0199 (12)
C100.2952 (5)0.36794 (10)0.2607 (3)0.0231 (12)
C110.2045 (5)0.36303 (10)0.1584 (3)0.0239 (14)
C120.2499 (4)0.40405 (10)0.2957 (3)0.0177 (11)
C130.1009 (4)0.40561 (10)0.2885 (3)0.0198 (12)
C140.0552 (4)0.36497 (10)0.1504 (3)0.0215 (12)
C150.0868 (4)0.33976 (10)0.3140 (3)0.0222 (12)
C160.2525 (4)0.33798 (10)0.3246 (3)0.0230 (12)
C170.3190 (5)0.34224 (12)0.4334 (3)0.0274 (12)
C180.0719 (5)0.34417 (11)0.4153 (3)0.0270 (14)
C190.2248 (5)0.35578 (12)0.5717 (3)0.0324 (14)
C200.3463 (5)0.37695 (11)0.6362 (3)0.0286 (14)
C210.4125 (5)0.40690 (12)0.6039 (3)0.0362 (16)
C220.5248 (5)0.42606 (14)0.6686 (4)0.0442 (17)
C230.5708 (5)0.41519 (15)0.7654 (4)0.0444 (17)
C240.5040 (5)0.38608 (13)0.7984 (4)0.0418 (17)
C250.3914 (5)0.36709 (11)0.7339 (3)0.0315 (16)
C260.1629 (6)0.46440 (13)0.6732 (4)0.0441 (17)
C270.1147 (5)0.43607 (12)0.7228 (3)0.0363 (17)
C280.1983 (5)0.43684 (12)0.8190 (3)0.0352 (17)
C290.2988 (5)0.46588 (12)0.8285 (3)0.0344 (17)
C300.2756 (6)0.48300 (12)0.7385 (4)0.0408 (16)
C310.0434 (5)0.45710 (12)0.0730 (3)0.0352 (14)
C320.0054 (5)0.48785 (12)0.1192 (3)0.0343 (17)
C330.1292 (5)0.50943 (12)0.1553 (3)0.0363 (16)
C340.2460 (5)0.49184 (13)0.1307 (3)0.0382 (17)
C350.1924 (5)0.45915 (13)0.0803 (3)0.0357 (16)
C360.1527 (15)0.2641 (2)0.1538 (5)0.035 (2)0.695 (14)
C370.2299 (8)0.2650 (2)0.0824 (9)0.034 (2)0.695 (14)
C380.1291 (13)0.2664 (3)−0.0090 (6)0.040 (2)0.695 (14)
C39−0.0087 (10)0.2656 (3)0.0066 (8)0.045 (2)0.695 (14)
C400.0047 (12)0.2642 (2)0.1068 (10)0.041 (2)0.695 (14)
C36'0.080 (4)0.2637 (6)0.1490 (12)0.038 (3)0.305 (14)
C37'0.210 (2)0.2651 (6)0.120 (2)0.038 (3)0.305 (14)
C38'0.174 (3)0.2642 (7)0.0184 (19)0.039 (3)0.305 (14)
C39'0.023 (3)0.2653 (9)−0.0137 (13)0.040 (3)0.305 (14)
C40'−0.036 (2)0.2645 (6)0.066 (2)0.038 (3)0.305 (14)
P10.1054 (5)0.07542 (11)0.5810 (3)0.0289 (8)0.771 (8)
F10.2519 (7)0.0632 (2)0.6539 (6)0.056 (2)0.771 (8)
F2−0.0407 (7)0.0877 (2)0.5070 (6)0.0428 (19)0.771 (8)
F30.0238 (5)0.0703 (3)0.6613 (3)0.079 (2)0.771 (8)
F40.1375 (6)0.11660 (12)0.6126 (5)0.0693 (18)0.771 (8)
F50.1878 (5)0.08150 (19)0.4999 (3)0.0600 (18)0.771 (8)
F60.0749 (6)0.03495 (11)0.5467 (5)0.083 (2)0.771 (8)
P20.26055 (12)0.06345 (3)0.98701 (8)0.0278 (3)
F70.3738 (3)0.03292 (7)0.97633 (19)0.0480 (10)
F80.1462 (3)0.09362 (7)0.9970 (2)0.0483 (10)
F90.2260 (3)0.07187 (8)0.87556 (18)0.0502 (10)
F100.1356 (3)0.03332 (7)0.9670 (2)0.0520 (10)
F110.2941 (3)0.05429 (7)1.09911 (17)0.0412 (9)
F120.3842 (3)0.09325 (8)1.0084 (2)0.0572 (11)
P30.0304 (7)0.22339 (17)0.3995 (4)0.0452 (12)0.630 (6)
F13−0.0908 (10)0.1947 (3)0.4051 (7)0.086 (3)0.630 (6)
F140.1504 (11)0.2524 (3)0.3901 (8)0.066 (3)0.630 (6)
F150.1541 (8)0.1989 (2)0.4607 (7)0.103 (3)0.630 (6)
F160.0423 (11)0.20427 (19)0.3037 (5)0.089 (3)0.630 (6)
F17−0.0885 (8)0.2497 (2)0.3388 (6)0.102 (3)0.630 (6)
F180.0114 (10)0.24368 (18)0.4908 (5)0.085 (3)0.630 (6)
P1'0.098 (2)0.0765 (4)0.5813 (12)0.039 (2)0.229 (8)
F1'0.254 (2)0.0743 (7)0.6533 (19)0.048 (5)0.229 (8)
F2'−0.058 (2)0.0803 (8)0.508 (2)0.039 (4)0.229 (8)
F3'0.037 (2)0.0938 (6)0.6624 (10)0.056 (4)0.229 (8)
F4'0.1324 (18)0.1166 (4)0.5543 (14)0.061 (4)0.229 (8)
F5'0.154 (2)0.0604 (6)0.4957 (11)0.062 (4)0.229 (8)
F6'0.0532 (18)0.0382 (4)0.6097 (16)0.068 (4)0.229 (8)
P3'0.0318 (14)0.2223 (4)0.4008 (9)0.063 (2)0.370 (6)
F13'−0.0574 (19)0.1919 (5)0.4378 (13)0.090 (4)0.370 (6)
F14'0.125 (2)0.2533 (6)0.3677 (15)0.075 (4)0.370 (6)
F15'0.1375 (13)0.1921 (3)0.3847 (12)0.086 (3)0.370 (6)
F16'−0.0595 (16)0.2184 (3)0.2931 (8)0.092 (3)0.370 (6)
F17'−0.0751 (13)0.2529 (3)0.4159 (12)0.088 (4)0.370 (6)
F18'0.1194 (17)0.2283 (4)0.5071 (7)0.102 (4)0.370 (6)
O10.5020 (4)0.28486 (11)0.2867 (3)0.0702 (18)
C410.6113 (6)0.30171 (15)0.2912 (5)0.055 (2)
C420.6821 (7)0.32293 (19)0.3779 (6)0.096 (3)
C430.6812 (8)0.3018 (2)0.2116 (5)0.099 (4)
O21.0209 (13)0.35608 (19)0.7582 (4)0.075 (3)0.82 (2)
C440.9494 (13)0.3322 (2)0.7141 (6)0.053 (3)0.82 (2)
C451.0180 (13)0.2975 (3)0.6967 (10)0.097 (5)0.82 (2)
C460.7926 (14)0.3362 (3)0.6691 (11)0.106 (6)0.82 (2)
O2'0.925 (5)0.3647 (7)0.7532 (18)0.065 (6)0.18 (2)
C44'0.880 (5)0.3379 (10)0.708 (4)0.066 (7)0.18 (2)
C45'0.975 (5)0.3050 (11)0.723 (3)0.073 (8)0.18 (2)
C46'0.727 (5)0.3335 (12)0.657 (3)0.062 (8)0.18 (2)
H60.344000.482500.404300.0320*
H70.097700.484300.398200.0330*
H1−0.144900.362200.053700.0380*
H2−0.056200.35800−0.084800.0450*
H30.190500.35670−0.070800.0470*
H40.356300.356800.081600.0350*
H50.440700.431900.338500.0260*
H17A0.343000.318100.464200.0330*
H17B0.407800.357200.446000.0330*
H18A−0.010300.360300.416300.0320*
H18B0.056500.320200.442800.0320*
H19A0.240000.329500.587100.0390*
H19B0.133600.363100.586500.0390*
H210.381800.414300.538700.0440*
H220.569300.446300.646600.0530*
H230.647700.427800.808200.0530*
H240.533800.379000.864000.0500*
H250.345300.347300.756700.0380*
H260.126100.470100.607000.0530*
H270.039100.419400.696300.0440*
H280.188800.420700.868700.0420*
H290.369100.472600.885500.0420*
H300.327000.503500.724100.0490*
H31−0.020000.438300.042200.0420*
H32−0.088600.493300.125200.0410*
H330.133500.531700.189800.0440*
H340.342800.500300.145300.0460*
H350.247300.441800.056000.0430*
H360.193500.263500.221200.0420*0.695 (14)
H370.331900.264600.093800.0410*0.695 (14)
H380.151100.26770−0.069500.0470*0.695 (14)
H39−0.097000.26600−0.042100.0540*0.695 (14)
H40−0.072400.263500.136900.0490*0.695 (14)
H8−0.058800.436800.321100.0270*
H9−0.085900.373700.236800.0240*
H100.400700.367400.264700.0270*
H150.041800.316100.287000.0260*
H160.277900.313400.303500.0280*
H36'0.072100.262400.213300.0450*0.305 (14)
H37'0.304300.266400.161100.0460*0.305 (14)
H38'0.239500.26310−0.020700.0470*0.305 (14)
H39'−0.030800.26630−0.079000.0480*0.305 (14)
H40'−0.135500.264500.064400.0460*0.305 (14)
H42A0.623800.321600.424400.1440*
H42B0.691400.348500.360100.1440*
H42C0.778000.312700.406600.1440*
H43A0.639100.282500.165700.1490*
H43B0.784800.297300.236900.1490*
H43C0.666400.325600.179300.1490*
H45A0.997400.293100.627400.1460*0.82 (2)
H45B0.979500.277300.727200.1460*0.82 (2)
H45C1.122500.299200.723800.1460*0.82 (2)
H46A0.743200.342600.718400.1590*0.82 (2)
H46B0.754100.313000.638800.1590*0.82 (2)
H46C0.776800.355500.620400.1590*0.82 (2)
H45D1.033700.305200.676300.1090*0.18 (2)
H45E0.915500.282900.713500.1090*0.18 (2)
H45F1.038500.305200.788100.1090*0.18 (2)
H46D0.673100.355300.667600.0930*0.18 (2)
H46E0.687700.311900.682200.0930*0.18 (2)
H46F0.717300.330400.588500.0930*0.18 (2)
Atomic displacement parameters (Å2)
U11U22U33U12U13U23
Ru10.0267 (2)0.0254 (2)0.0182 (2)0.0005 (2)0.0047 (1)−0.0010 (1)
Ru20.0226 (2)0.0200 (2)0.0229 (2)0.0027 (1)0.0073 (1)−0.0001 (1)
Ru30.0363 (2)0.0283 (2)0.0252 (2)0.0004 (2)0.0082 (2)−0.0074 (2)
N10.028 (2)0.0276 (18)0.0170 (17)−0.0015 (16)0.0086 (15)−0.0051 (14)
C10.032 (3)0.030 (2)0.030 (3)0.007 (2)0.001 (2)−0.0070 (19)
C20.053 (3)0.035 (3)0.021 (2)0.004 (2)0.003 (2)0.0002 (19)
C30.055 (4)0.037 (3)0.027 (3)−0.001 (2)0.015 (2)−0.002 (2)
C40.036 (3)0.026 (2)0.030 (2)0.001 (2)0.017 (2)−0.0024 (18)
C50.019 (2)0.024 (2)0.021 (2)−0.0011 (17)0.0021 (17)0.0009 (17)
C60.030 (3)0.022 (2)0.026 (2)−0.0011 (18)0.0043 (19)−0.0021 (17)
C70.039 (3)0.025 (2)0.019 (2)0.0076 (19)0.010 (2)−0.0058 (17)
C80.024 (2)0.023 (2)0.021 (2)0.0038 (17)0.0083 (18)0.0000 (16)
C90.017 (2)0.022 (2)0.020 (2)−0.0017 (17)0.0035 (17)−0.0045 (16)
C100.025 (2)0.024 (2)0.019 (2)0.0016 (18)0.0034 (18)−0.0026 (17)
C110.032 (3)0.016 (2)0.024 (2)0.0007 (18)0.008 (2)−0.0039 (16)
C120.022 (2)0.018 (2)0.0130 (19)0.0026 (16)0.0043 (17)0.0024 (15)
C130.022 (2)0.022 (2)0.014 (2)0.0015 (17)0.0020 (17)0.0009 (16)
C140.025 (2)0.018 (2)0.020 (2)0.0052 (17)0.0031 (18)−0.0040 (16)
C150.027 (2)0.019 (2)0.020 (2)−0.0035 (17)0.0053 (18)−0.0034 (16)
C160.026 (2)0.018 (2)0.025 (2)0.0018 (17)0.0066 (19)−0.0016 (17)
C170.027 (2)0.031 (2)0.025 (2)0.0036 (19)0.0083 (19)0.0004 (18)
C180.032 (3)0.027 (2)0.024 (2)−0.0031 (19)0.011 (2)−0.0006 (18)
C190.041 (3)0.033 (2)0.026 (2)−0.009 (2)0.014 (2)−0.0046 (19)
C200.033 (3)0.032 (2)0.023 (2)0.003 (2)0.011 (2)−0.0035 (18)
C210.045 (3)0.044 (3)0.026 (2)−0.007 (2)0.021 (2)−0.008 (2)
C220.040 (3)0.048 (3)0.054 (3)−0.014 (2)0.029 (3)−0.013 (3)
C230.027 (3)0.057 (3)0.046 (3)0.002 (2)0.004 (2)−0.022 (3)
C240.040 (3)0.045 (3)0.036 (3)0.021 (3)0.002 (2)−0.008 (2)
C250.039 (3)0.025 (2)0.030 (3)0.011 (2)0.008 (2)−0.0041 (19)
C260.047 (3)0.044 (3)0.037 (3)0.020 (3)0.003 (3)0.005 (2)
C270.023 (3)0.033 (3)0.051 (3)0.006 (2)0.006 (2)−0.013 (2)
C280.041 (3)0.033 (3)0.037 (3)0.009 (2)0.020 (2)−0.001 (2)
C290.035 (3)0.031 (3)0.036 (3)0.010 (2)0.007 (2)−0.007 (2)
C300.049 (3)0.025 (2)0.049 (3)0.004 (2)0.014 (3)0.000 (2)
C310.050 (3)0.028 (2)0.024 (2)0.002 (2)0.003 (2)0.0081 (19)
C320.033 (3)0.037 (3)0.033 (3)0.012 (2)0.009 (2)0.018 (2)
C330.046 (3)0.025 (2)0.041 (3)0.006 (2)0.017 (2)0.009 (2)
C340.039 (3)0.041 (3)0.040 (3)−0.001 (2)0.020 (2)0.015 (2)
C350.044 (3)0.042 (3)0.027 (2)0.014 (2)0.020 (2)0.009 (2)
C360.050 (5)0.021 (3)0.035 (3)−0.002 (4)0.015 (3)−0.005 (3)
C370.046 (4)0.022 (3)0.036 (4)0.005 (3)0.013 (3)−0.008 (3)
C380.050 (5)0.034 (3)0.032 (4)0.003 (4)0.006 (3)−0.013 (3)
C390.046 (4)0.039 (3)0.047 (4)−0.009 (4)0.009 (4)−0.018 (4)
C400.046 (4)0.030 (3)0.047 (5)−0.007 (4)0.014 (4)−0.012 (4)
C36'0.050 (6)0.026 (5)0.038 (5)−0.003 (6)0.013 (5)−0.007 (5)
C37'0.048 (5)0.027 (5)0.039 (6)0.002 (5)0.010 (5)−0.008 (5)
C38'0.048 (5)0.030 (5)0.040 (5)0.001 (5)0.014 (5)−0.013 (5)
C39'0.050 (6)0.036 (5)0.035 (5)−0.008 (5)0.015 (5)−0.018 (5)
C40'0.046 (5)0.032 (5)0.037 (6)−0.008 (5)0.014 (5)−0.012 (6)
P10.0246 (14)0.0324 (13)0.0265 (13)−0.0016 (12)0.0008 (11)0.0006 (12)
F10.038 (3)0.074 (5)0.045 (3)0.011 (3)−0.011 (2)0.008 (3)
F20.028 (3)0.058 (4)0.036 (3)0.003 (2)−0.003 (2)0.006 (3)
F30.046 (3)0.155 (6)0.033 (2)−0.024 (4)0.0078 (19)0.021 (3)
F40.064 (3)0.049 (2)0.082 (4)−0.003 (2)−0.004 (3)−0.028 (3)
F50.041 (3)0.104 (4)0.038 (2)0.001 (3)0.0158 (19)0.012 (3)
F60.104 (4)0.027 (2)0.086 (4)−0.003 (2)−0.031 (3)−0.002 (2)
P20.0248 (6)0.0338 (6)0.0255 (6)0.0025 (5)0.0078 (5)0.0078 (5)
F70.0492 (18)0.0548 (18)0.0438 (17)0.0218 (14)0.0188 (14)0.0107 (14)
F80.0517 (19)0.0462 (17)0.0535 (18)0.0212 (14)0.0255 (15)0.0119 (14)
F90.0493 (19)0.077 (2)0.0269 (14)0.0233 (16)0.0144 (13)0.0212 (14)
F100.0394 (17)0.0513 (18)0.0562 (19)−0.0142 (14)−0.0039 (15)0.0106 (14)
F110.0344 (16)0.0637 (18)0.0249 (14)0.0029 (13)0.0065 (12)0.0096 (12)
F120.0465 (19)0.0540 (18)0.069 (2)−0.0229 (15)0.0113 (16)0.0123 (15)
P30.058 (2)0.032 (2)0.052 (2)−0.0043 (18)0.0259 (19)−0.0014 (19)
F130.099 (5)0.085 (5)0.090 (6)−0.043 (4)0.056 (5)−0.023 (4)
F140.071 (4)0.051 (4)0.075 (6)−0.020 (3)0.016 (4)0.002 (4)
F150.097 (4)0.079 (4)0.128 (6)0.022 (4)0.019 (4)0.050 (4)
F160.133 (6)0.067 (4)0.087 (4)−0.041 (4)0.066 (4)−0.033 (3)
F170.091 (4)0.100 (5)0.096 (5)0.025 (4)−0.010 (4)0.013 (4)
F180.123 (6)0.082 (4)0.060 (4)−0.007 (4)0.043 (4)−0.022 (3)
P1'0.035 (4)0.045 (4)0.034 (4)0.000 (4)0.005 (4)0.001 (4)
F1'0.034 (6)0.063 (10)0.038 (7)0.004 (6)−0.004 (5)0.008 (7)
F2'0.029 (6)0.043 (8)0.038 (7)−0.008 (6)−0.002 (6)−0.001 (6)
F3'0.052 (7)0.082 (8)0.030 (6)0.024 (7)0.006 (5)−0.010 (6)
F4'0.054 (7)0.054 (5)0.062 (8)−0.028 (5)−0.010 (7)0.019 (6)
F5'0.052 (7)0.090 (8)0.042 (6)0.025 (7)0.011 (5)−0.010 (6)
F6'0.068 (7)0.043 (6)0.076 (8)−0.024 (5)−0.012 (7)0.025 (6)
P3'0.075 (4)0.048 (4)0.067 (4)−0.010 (4)0.022 (4)−0.005 (4)
F13'0.103 (8)0.069 (6)0.101 (9)−0.023 (5)0.031 (7)0.023 (6)
F14'0.099 (8)0.052 (6)0.079 (8)−0.026 (6)0.033 (7)−0.004 (6)
F15'0.092 (6)0.056 (5)0.112 (7)0.007 (4)0.032 (6)−0.012 (6)
F16'0.111 (7)0.067 (6)0.076 (5)−0.015 (6)−0.014 (5)−0.001 (5)
F17'0.094 (6)0.063 (5)0.114 (8)0.007 (5)0.040 (6)−0.011 (6)
F18'0.122 (8)0.105 (7)0.067 (5)−0.009 (6)0.003 (5)−0.005 (5)
O10.040 (2)0.068 (3)0.105 (4)−0.008 (2)0.023 (2)−0.015 (2)
C410.042 (4)0.040 (3)0.078 (4)0.010 (3)0.007 (3)0.007 (3)
C420.050 (4)0.097 (5)0.132 (7)−0.002 (4)0.008 (4)−0.061 (5)
C430.085 (6)0.127 (7)0.089 (6)−0.015 (5)0.029 (5)0.029 (5)
O20.107 (7)0.073 (4)0.045 (3)−0.032 (4)0.018 (3)−0.008 (3)
C440.083 (7)0.044 (5)0.033 (4)−0.023 (5)0.019 (5)0.003 (3)
C450.108 (9)0.065 (6)0.131 (10)−0.035 (6)0.054 (7)−0.010 (6)
C460.087 (10)0.074 (7)0.146 (12)−0.009 (7)0.012 (10)0.022 (7)
O2'0.080 (12)0.060 (9)0.055 (9)−0.011 (8)0.017 (8)−0.010 (7)
C44'0.082 (14)0.059 (11)0.059 (11)−0.007 (10)0.024 (10)−0.016 (9)
C45'0.084 (16)0.067 (13)0.066 (14)−0.002 (12)0.017 (13)−0.014 (12)
C46'0.079 (16)0.052 (13)0.061 (13)−0.005 (12)0.030 (12)−0.029 (11)
Geometric parameters (Å, º)
Ru1—C202.237 (4)C19—C201.504 (6)
Ru1—C212.195 (4)C20—C251.409 (6)
Ru1—C222.169 (5)C20—C211.405 (6)
Ru1—C232.191 (5)C21—C221.415 (7)
Ru1—C242.206 (5)C22—C231.408 (8)
Ru1—C252.211 (4)C23—C241.389 (7)
Ru1—C262.177 (5)C24—C251.413 (7)
Ru1—C272.166 (5)C26—C301.412 (8)
Ru1—C282.155 (5)C26—C271.404 (7)
Ru1—C292.165 (4)C27—C281.411 (6)
Ru1—C302.187 (5)C28—C291.418 (7)
Ru2—C52.218 (4)C29—C301.406 (7)
Ru2—C62.199 (4)C31—C351.410 (7)
Ru2—C72.203 (4)C31—C321.403 (6)
Ru2—C82.210 (5)C32—C331.409 (7)
Ru2—C122.235 (4)C33—C341.416 (7)
Ru2—C132.214 (4)C34—C351.424 (7)
Ru2—C312.184 (4)C36—C371.417 (16)
Ru2—C322.163 (4)C36—C401.407 (18)
Ru2—C332.167 (4)C36'—C37'1.42 (4)
Ru2—C342.182 (5)C36'—C40'1.41 (4)
Ru2—C352.182 (4)C37—C381.420 (15)
Ru3—C12.208 (4)C37'—C38'1.42 (4)
Ru3—C22.164 (4)C38—C391.399 (16)
Ru3—C32.170 (5)C38'—C39'1.40 (4)
Ru3—C42.191 (4)C39—C401.418 (18)
Ru3—C112.246 (4)C39'—C40'1.41 (3)
Ru3—C142.266 (4)C1—H10.9500
Ru3—C362.179 (7)C2—H20.9500
Ru3—C372.178 (8)C3—H30.9500
Ru3—C382.167 (10)C4—H40.9500
Ru3—C392.165 (11)C5—H50.9500
Ru3—C402.179 (9)C6—H60.9500
Ru3—C36'2.20 (2)C7—H70.9500
Ru3—C37'2.12 (2)C8—H80.9500
Ru3—C38'2.18 (3)C9—H91.0000
Ru3—C39'2.20 (3)C10—H101.0000
Ru3—C40'2.24 (2)C15—H151.0000
P1—F11.587 (9)C16—H161.0000
P1—F21.591 (9)C17—H17B0.9900
P1—F31.569 (7)C17—H17A0.9900
P1—F41.580 (6)C18—H18B0.9900
P1—F51.589 (6)C18—H18A0.9900
P1—F61.564 (6)C19—H19B0.9900
P2—F71.594 (3)C19—H19A0.9900
P2—F81.590 (3)C21—H210.9500
P2—F91.585 (3)C22—H220.9500
P2—F101.599 (3)C23—H230.9500
P2—F111.600 (3)C24—H240.9500
P2—F121.582 (3)C25—H250.9500
P3—F131.585 (12)C26—H260.9500
P3—F141.598 (13)C27—H270.9500
P3—F151.565 (11)C28—H280.9500
P3—F161.579 (9)C29—H290.9500
P3—F171.574 (10)C30—H300.9500
P3—F181.563 (9)C31—H310.9500
P1'—F1'1.59 (3)C32—H320.9500
P1'—F2'1.60 (3)C33—H330.9500
P1'—F3'1.57 (2)C34—H340.9500
P1'—F4'1.57 (2)C35—H350.9500
P1'—F5'1.58 (2)C36—H360.9500
P1'—F6'1.55 (2)C36'—H36'0.9500
P3'—F13'1.58 (2)C37—H370.9500
P3'—F14'1.59 (3)C37'—H37'0.9500
P3'—F15'1.558 (19)C38—H380.9500
P3'—F16'1.580 (17)C38'—H38'0.9500
P3'—F17'1.572 (19)C39—H390.9500
P3'—F18'1.561 (17)C39'—H39'0.9500
N1—C191.449 (5)C40—H400.9500
N1—C171.464 (6)C40'—H40'0.9500
N1—C181.466 (6)C41—C421.479 (10)
O1—C411.205 (7)C41—C431.473 (10)
O2—C441.188 (12)C42—H42B0.9800
O2'—C44'1.19 (5)C42—H42C0.9800
C1—C141.411 (6)C42—H42A0.9800
C1—C21.417 (7)C43—H43B0.9800
C2—C31.388 (8)C43—H43A0.9800
C3—C41.404 (6)C43—H43C0.9800
C4—C111.407 (6)C44—C451.481 (15)
C5—C61.419 (6)C44—C461.485 (19)
C5—C121.394 (5)C45—H45B0.9800
C6—C71.403 (7)C45—H45C0.9800
C7—C81.419 (6)C45—H45A0.9800
C8—C131.408 (6)C46—H46B0.9800
C9—C131.521 (5)C46—H46C0.9800
C9—C151.554 (5)C46—H46A0.9800
C9—C141.500 (6)C44'—C45'1.49 (6)
C10—C161.554 (6)C44'—C46'1.47 (7)
C10—C111.517 (6)C45'—H45D0.9800
C10—C121.517 (5)C45'—H45E0.9800
C11—C141.410 (6)C45'—H45F0.9800
C12—C131.409 (6)C46'—H46D0.9800
C15—C181.513 (6)C46'—H46E0.9800
C15—C161.560 (6)C46'—H46F0.9700
C16—C171.541 (6)
C20—Ru1—C2136.96 (16)Ru2—C6—C771.6 (2)
C20—Ru1—C2267.34 (19)C5—C6—C7120.3 (4)
C20—Ru1—C2379.35 (19)Ru2—C7—C671.3 (3)
C20—Ru1—C2467.16 (18)Ru2—C7—C871.5 (2)
C20—Ru1—C2536.94 (15)C6—C7—C8120.7 (4)
C20—Ru1—C26116.59 (18)Ru2—C8—C771.0 (3)
C20—Ru1—C27107.61 (17)C7—C8—C13118.5 (4)
C20—Ru1—C28128.97 (17)Ru2—C8—C1371.6 (2)
C20—Ru1—C29167.01 (17)C13—C9—C14107.2 (3)
C20—Ru1—C30149.30 (18)C14—C9—C15108.4 (3)
C21—Ru1—C2237.85 (19)C13—C9—C15105.3 (3)
C21—Ru1—C2367.85 (19)C11—C10—C16108.7 (3)
C21—Ru1—C2479.64 (18)C11—C10—C12106.5 (3)
C21—Ru1—C2566.74 (16)C12—C10—C16105.9 (3)
C21—Ru1—C26107.39 (19)Ru3—C11—C469.4 (2)
C21—Ru1—C27123.89 (17)Ru3—C11—C10134.0 (3)
C21—Ru1—C28160.29 (17)C4—C11—C14120.5 (4)
C21—Ru1—C29155.76 (17)C10—C11—C14112.9 (4)
C21—Ru1—C30121.17 (19)Ru3—C11—C1472.6 (2)
C22—Ru1—C2337.7 (2)C4—C11—C10126.5 (4)
C22—Ru1—C2467.3 (2)Ru2—C12—C1370.7 (2)
C22—Ru1—C2579.27 (18)Ru2—C12—C571.1 (2)
C22—Ru1—C26120.1 (2)Ru2—C12—C10134.6 (3)
C22—Ru1—C27154.36 (18)C10—C12—C13112.6 (3)
C22—Ru1—C28161.75 (19)C5—C12—C10126.2 (4)
C22—Ru1—C29124.77 (19)C5—C12—C13121.1 (4)
C22—Ru1—C30107.5 (2)Ru2—C13—C9132.5 (3)
C23—Ru1—C2436.83 (19)C8—C13—C12120.5 (4)
C23—Ru1—C2566.75 (19)Ru2—C13—C1272.4 (2)
C23—Ru1—C26148.3 (2)C8—C13—C9126.1 (4)
C23—Ru1—C27167.59 (18)Ru2—C13—C871.3 (2)
C23—Ru1—C28129.58 (19)C9—C13—C12113.3 (3)
C23—Ru1—C29107.38 (19)Ru3—C14—C9134.3 (3)
C23—Ru1—C30115.9 (2)Ru3—C14—C1171.0 (2)
C24—Ru1—C2537.30 (18)Ru3—C14—C169.4 (2)
C24—Ru1—C26172.4 (2)C1—C14—C11120.0 (4)
C24—Ru1—C27135.73 (18)C9—C14—C11113.3 (4)
C24—Ru1—C28109.01 (18)C1—C14—C9126.7 (4)
C24—Ru1—C29111.35 (18)C16—C15—C18105.0 (3)
C24—Ru1—C30140.9 (2)C9—C15—C18114.6 (3)
C25—Ru1—C26142.34 (18)C9—C15—C16109.4 (3)
C25—Ru1—C27112.44 (17)C15—C16—C17103.8 (3)
C25—Ru1—C28108.99 (17)C10—C16—C17115.4 (3)
C25—Ru1—C29134.88 (16)C10—C16—C15109.4 (3)
C25—Ru1—C30172.04 (19)N1—C17—C16105.2 (3)
C26—Ru1—C2737.72 (19)N1—C18—C15105.3 (4)
C26—Ru1—C2863.39 (19)N1—C19—C20115.5 (4)
C26—Ru1—C2963.39 (19)Ru1—C20—C2570.5 (2)
C26—Ru1—C3037.7 (2)C19—C20—C21122.8 (4)
C27—Ru1—C2838.13 (16)C19—C20—C25118.3 (4)
C27—Ru1—C2963.82 (17)C21—C20—C25118.9 (4)
C27—Ru1—C3063.21 (19)Ru1—C20—C19129.6 (3)
C28—Ru1—C2938.31 (17)Ru1—C20—C2169.9 (2)
C28—Ru1—C3063.33 (19)Ru1—C21—C2073.2 (3)
C29—Ru1—C3037.68 (18)C20—C21—C22120.0 (4)
C5—Ru2—C637.47 (15)Ru1—C21—C2270.1 (3)
C5—Ru2—C767.24 (16)C21—C22—C23120.2 (5)
C5—Ru2—C879.93 (16)Ru1—C22—C2372.0 (3)
C5—Ru2—C1236.48 (14)Ru1—C22—C2172.1 (3)
C5—Ru2—C1366.83 (14)Ru1—C23—C2270.3 (3)
C5—Ru2—C31146.75 (16)Ru1—C23—C2472.2 (3)
C5—Ru2—C32170.45 (16)C22—C23—C24120.1 (5)
C5—Ru2—C33132.48 (16)Ru1—C24—C2371.0 (3)
C5—Ru2—C34109.60 (16)Ru1—C24—C2571.5 (3)
C5—Ru2—C35115.84 (17)C23—C24—C25119.6 (5)
C6—Ru2—C737.18 (18)Ru1—C25—C2072.5 (2)
C6—Ru2—C867.61 (17)Ru1—C25—C2471.2 (3)
C6—Ru2—C1266.21 (15)C20—C25—C24121.1 (4)
C6—Ru2—C1379.01 (15)Ru1—C26—C2770.7 (3)
C6—Ru2—C31172.95 (16)C27—C26—C30108.2 (5)
C6—Ru2—C32136.94 (16)Ru1—C26—C3071.5 (3)
C6—Ru2—C33109.47 (16)Ru1—C27—C2671.6 (3)
C6—Ru2—C34110.99 (17)Ru1—C27—C2870.5 (3)
C6—Ru2—C35140.02 (18)C26—C27—C28107.9 (4)
C7—Ru2—C837.52 (16)Ru1—C28—C2771.3 (3)
C7—Ru2—C1278.23 (15)C27—C28—C29108.0 (4)
C7—Ru2—C1366.74 (15)Ru1—C28—C2971.2 (3)
C7—Ru2—C31143.17 (18)C28—C29—C30107.7 (4)
C7—Ru2—C32112.14 (17)Ru1—C29—C3072.0 (3)
C7—Ru2—C33106.81 (16)Ru1—C29—C2870.5 (3)
C7—Ru2—C34132.05 (16)Ru1—C30—C2670.8 (3)
C7—Ru2—C35169.80 (16)Ru1—C30—C2970.3 (3)
C8—Ru2—C1266.77 (15)C26—C30—C29108.2 (4)
C8—Ru2—C1337.13 (14)Ru2—C31—C3270.4 (2)
C8—Ru2—C31116.44 (17)C32—C31—C35107.8 (4)
C8—Ru2—C32105.46 (17)Ru2—C31—C3571.1 (2)
C8—Ru2—C33125.31 (16)Ru2—C32—C3172.0 (3)
C8—Ru2—C34162.98 (16)Ru2—C32—C3371.1 (3)
C8—Ru2—C35150.54 (17)C31—C32—C33109.0 (4)
C12—Ru2—C1336.92 (15)Ru2—C33—C3270.9 (3)
C12—Ru2—C31120.41 (16)Ru2—C33—C3471.6 (3)
C12—Ru2—C32152.91 (16)C32—C33—C34107.5 (4)
C12—Ru2—C33165.74 (17)C33—C34—C35107.7 (4)
C12—Ru2—C34129.20 (17)Ru2—C34—C3571.0 (3)
C12—Ru2—C35110.18 (16)Ru2—C34—C3370.4 (3)
C13—Ru2—C31107.74 (16)Ru2—C35—C3171.2 (3)
C13—Ru2—C32122.20 (16)Ru2—C35—C3471.0 (2)
C13—Ru2—C33157.34 (17)C31—C35—C34108.0 (4)
C13—Ru2—C34159.41 (16)Ru3—C36—C4071.2 (5)
C13—Ru2—C35123.44 (16)Ru3—C36—C3771.0 (4)
C31—Ru2—C3237.65 (17)C37—C36—C40107.7 (8)
C31—Ru2—C3363.51 (16)C37'—C36'—C40'108 (2)
C31—Ru2—C3463.33 (17)Ru3—C36'—C40'73.1 (12)
C31—Ru2—C3537.67 (18)Ru3—C36'—C37'67.5 (14)
C32—Ru2—C3338.00 (17)Ru3—C37—C3870.5 (6)
C32—Ru2—C3463.24 (18)Ru3—C37—C3671.1 (5)
C32—Ru2—C3563.07 (18)C36—C37—C38108.4 (9)
C33—Ru2—C3438.00 (18)Ru3—C37'—C36'74.3 (13)
C33—Ru2—C3563.65 (17)C36'—C37'—C38'108 (2)
C34—Ru2—C3538.09 (17)Ru3—C37'—C38'73.3 (15)
C1—Ru3—C237.81 (17)C37—C38—C39107.2 (9)
C1—Ru3—C367.71 (19)Ru3—C38—C3771.4 (5)
C1—Ru3—C480.11 (17)Ru3—C38—C3971.1 (6)
C1—Ru3—C1166.53 (16)Ru3—C38'—C37'68.3 (14)
C1—Ru3—C1436.73 (15)C37'—C38'—C39'107 (2)
C1—Ru3—C36139.6 (4)Ru3—C38'—C39'72.1 (17)
C1—Ru3—C37175.7 (2)Ru3—C39—C3871.2 (6)
C1—Ru3—C38139.6 (3)Ru3—C39—C4071.5 (6)
C1—Ru3—C39113.0 (3)C38—C39—C40109.0 (9)
C1—Ru3—C40112.8 (3)Ru3—C39'—C40'73.2 (14)
C1—Ru3—C36'124.5 (9)Ru3—C39'—C38'70.5 (15)
C1—Ru3—C37'161.6 (7)C38'—C39'—C40'109.3 (19)
C1—Ru3—C38'153.1 (7)Ru3—C40—C3970.4 (6)
C1—Ru3—C39'118.9 (8)Ru3—C40—C3671.2 (5)
C1—Ru3—C40'106.7 (6)C36—C40—C39107.7 (10)
C2—Ru3—C337.4 (2)Ru3—C40'—C39'69.9 (15)
C2—Ru3—C467.72 (18)Ru3—C40'—C36'70.0 (13)
C2—Ru3—C1178.75 (16)C36'—C40'—C39'107 (2)
C2—Ru3—C1466.58 (16)C2—C1—H1121.00
C2—Ru3—C36168.5 (3)C14—C1—H1121.00
C2—Ru3—C37143.4 (3)Ru3—C1—H1128.00
C2—Ru3—C38111.2 (3)C1—C2—H2120.00
C2—Ru3—C39106.1 (3)C3—C2—H2120.00
C2—Ru3—C40131.0 (4)Ru3—C2—H2128.00
C2—Ru3—C36'151.7 (10)C4—C3—H3120.00
C2—Ru3—C37'159.8 (7)C2—C3—H3120.00
C2—Ru3—C38'122.0 (7)Ru3—C3—H3130.00
C2—Ru3—C39'103.9 (7)Ru3—C4—H4127.00
C2—Ru3—C40'117.0 (6)C11—C4—H4120.00
C3—Ru3—C437.55 (17)C3—C4—H4120.00
C3—Ru3—C1166.54 (16)C6—C5—H5121.00
C3—Ru3—C1478.46 (16)C12—C5—H5121.00
C3—Ru3—C36151.3 (4)Ru2—C5—H5129.00
C3—Ru3—C37115.5 (3)Ru2—C6—H6129.00
C3—Ru3—C38101.8 (3)C5—C6—H6120.00
C3—Ru3—C39121.5 (3)C7—C6—H6120.00
C3—Ru3—C40159.3 (4)C6—C7—H7120.00
C3—Ru3—C36'167.7 (9)Ru2—C7—H7130.00
C3—Ru3—C37'129.9 (6)C8—C7—H7120.00
C3—Ru3—C38'105.5 (7)Ru2—C8—H8129.00
C3—Ru3—C39'112.2 (6)C7—C8—H8121.00
C3—Ru3—C40'143.7 (7)C13—C8—H8121.00
C4—Ru3—C1136.96 (16)C15—C9—H9112.00
C4—Ru3—C1466.56 (15)C13—C9—H9112.00
C4—Ru3—C36123.7 (4)C14—C9—H9112.00
C4—Ru3—C37104.2 (2)C12—C10—H10112.00
C4—Ru3—C38116.1 (3)C16—C10—H10112.00
C4—Ru3—C39151.1 (3)C11—C10—H10112.00
C4—Ru3—C40161.0 (4)C9—C15—H15109.00
C4—Ru3—C36'139.6 (8)C18—C15—H15109.00
C4—Ru3—C37'110.5 (6)C16—C15—H15109.00
C4—Ru3—C38'111.0 (8)C15—C16—H16109.00
C4—Ru3—C39'138.8 (7)C10—C16—H16109.00
C4—Ru3—C40'173.1 (6)C17—C16—H16109.00
C11—Ru3—C1436.42 (16)N1—C17—H17B111.00
C11—Ru3—C36111.1 (2)N1—C17—H17A111.00
C11—Ru3—C37117.1 (3)H17A—C17—H17B109.00
C11—Ru3—C38147.3 (4)C16—C17—H17A111.00
C11—Ru3—C39171.6 (3)C16—C17—H17B111.00
C11—Ru3—C40133.7 (4)C15—C18—H18A111.00
C11—Ru3—C36'118.0 (5)N1—C18—H18B111.00
C11—Ru3—C37'112.5 (7)C15—C18—H18B111.00
C11—Ru3—C38'136.6 (8)H18A—C18—H18B109.00
C11—Ru3—C39'173.9 (8)N1—C18—H18A111.00
C11—Ru3—C40'146.6 (7)N1—C19—H19A108.00
C14—Ru3—C36117.6 (2)H19A—C19—H19B108.00
C14—Ru3—C37145.3 (3)N1—C19—H19B108.00
C14—Ru3—C38176.0 (3)C20—C19—H19A108.00
C14—Ru3—C39138.9 (3)C20—C19—H19B108.00
C14—Ru3—C40115.0 (3)Ru1—C21—H21129.00
C14—Ru3—C36'112.2 (6)C20—C21—H21120.00
C14—Ru3—C37'132.4 (7)C22—C21—H21120.00
C14—Ru3—C38'170.2 (7)C23—C22—H22120.00
C14—Ru3—C39'149.7 (8)Ru1—C22—H22128.00
C14—Ru3—C40'119.6 (6)C21—C22—H22120.00
C36—Ru3—C3738.0 (4)C22—C23—H23120.00
C36—Ru3—C3863.9 (3)C24—C23—H23120.00
C36—Ru3—C3963.4 (4)Ru1—C23—H23130.00
C36—Ru3—C4037.7 (5)Ru1—C24—H24130.00
C37—Ru3—C3838.1 (4)C23—C24—H24120.00
C37—Ru3—C3963.0 (4)C25—C24—H24120.00
C37—Ru3—C4063.1 (4)C20—C25—H25119.00
C38—Ru3—C3937.7 (4)C24—C25—H25119.00
C38—Ru3—C4063.7 (4)Ru1—C25—H25129.00
C39—Ru3—C4038.1 (5)C27—C26—H26126.00
C36'—Ru3—C37'38.2 (11)C30—C26—H26126.00
C36'—Ru3—C38'63.0 (10)Ru1—C26—H26124.00
C36'—Ru3—C39'62.0 (8)C28—C27—H27126.00
C36'—Ru3—C40'36.9 (10)C26—C27—H27126.00
C37'—Ru3—C38'38.5 (10)Ru1—C27—H27124.00
C37'—Ru3—C39'63.4 (10)Ru1—C28—H28123.00
C37'—Ru3—C40'63.2 (8)C27—C28—H28126.00
C38'—Ru3—C39'37.4 (11)C29—C28—H28126.00
C38'—Ru3—C40'62.4 (9)C30—C29—H29126.00
C39'—Ru3—C40'36.9 (9)Ru1—C29—H29123.00
F4—P1—F6178.2 (5)C28—C29—H29126.00
F5—P1—F689.3 (4)C26—C30—H30126.00
F2—P1—F489.8 (4)Ru1—C30—H30124.00
F1—P1—F2179.4 (5)C29—C30—H30126.00
F1—P1—F390.3 (4)Ru2—C31—H31124.00
F1—P1—F490.2 (4)C32—C31—H31126.00
F1—P1—F590.1 (4)C35—C31—H31126.00
F1—P1—F690.2 (4)C31—C32—H32126.00
F2—P1—F390.4 (4)C33—C32—H32125.00
F3—P1—F489.9 (5)Ru2—C32—H32123.00
F2—P1—F589.3 (4)Ru2—C33—H33123.00
F2—P1—F689.7 (4)C32—C33—H33126.00
F4—P1—F589.0 (4)C34—C33—H33126.00
F3—P1—F5178.8 (6)C35—C34—H34126.00
F3—P1—F691.8 (5)C33—C34—H34126.00
F7—P2—F8179.37 (16)Ru2—C34—H34124.00
F11—P2—F1290.17 (15)C31—C35—H35126.00
F8—P2—F1190.95 (15)Ru2—C35—H35123.00
F7—P2—F990.38 (15)C34—C35—H35126.00
F7—P2—F1089.95 (15)C40—C36—H36126.00
F7—P2—F1189.28 (15)Ru3—C36—H36123.00
F7—P2—F1290.26 (16)C37—C36—H36126.00
F8—P2—F989.39 (16)C40'—C36'—H36'126.00
F8—P2—F1089.46 (15)Ru3—C36'—H36'125.00
F9—P2—F11179.03 (16)C37'—C36'—H36'126.00
F8—P2—F1290.33 (16)C36—C37—H37126.00
F9—P2—F1090.06 (16)C38—C37—H37126.00
F10—P2—F12179.17 (16)Ru3—C37—H37125.00
F9—P2—F1290.74 (16)Ru3—C37'—H37'118.00
F10—P2—F1189.03 (15)C36'—C37'—H37'126.00
F13—P3—F14178.1 (7)C38'—C37'—H37'126.00
F17—P3—F1887.2 (5)Ru3—C38—H38123.00
F14—P3—F1690.1 (6)C39—C38—H38126.00
F14—P3—F1789.0 (6)C37—C38—H38126.00
F13—P3—F1593.0 (6)Ru3—C38'—H38'125.00
F13—P3—F1688.4 (6)C37'—C38'—H38'126.00
F13—P3—F1789.8 (6)C39'—C38'—H38'126.00
F13—P3—F1891.3 (6)C40—C39—H39126.00
F14—P3—F1588.2 (6)C38—C39—H39126.00
F16—P3—F18176.7 (6)Ru3—C39—H39123.00
F15—P3—F17177.1 (6)C40'—C39'—H39'125.00
F14—P3—F1890.0 (6)C38'—C39'—H39'125.00
F15—P3—F1691.3 (6)Ru3—C39'—H39'123.00
F15—P3—F1892.0 (5)C39—C40—H40126.00
F16—P3—F1789.5 (5)C36—C40—H40126.00
F1'—P1'—F4'89.2 (15)Ru3—C40—H40124.00
F1'—P1'—F3'90.3 (14)C36'—C40'—H40'126.00
F1'—P1'—F2'177.8 (17)C39'—C40'—H40'127.00
F3'—P1'—F4'87.2 (13)Ru3—C40'—H40'125.00
F1'—P1'—F5'92.1 (15)O1—C41—C42121.2 (6)
F1'—P1'—F6'93.5 (15)O1—C41—C43121.8 (6)
F2'—P1'—F3'89.5 (15)C42—C41—C43117.1 (6)
F2'—P1'—F4'88.7 (15)C41—C42—H42A109.00
F2'—P1'—F5'88.1 (14)C41—C42—H42B109.00
F2'—P1'—F6'88.7 (16)C41—C42—H42C109.00
F4'—P1'—F5'91.0 (14)H42A—C42—H42B109.00
F3'—P1'—F5'177.0 (16)H42A—C42—H42C109.00
F3'—P1'—F6'89.1 (14)H42B—C42—H42C110.00
F4'—P1'—F6'175.5 (17)C41—C43—H43A109.00
F5'—P1'—F6'92.5 (13)C41—C43—H43B109.00
F13'—P3'—F16'93.3 (11)C41—C43—H43C109.00
F13'—P3'—F14'177.8 (14)H43A—C43—H43B109.00
F13'—P3'—F15'89.0 (11)H43A—C43—H43C110.00
F14'—P3'—F17'88.5 (12)H43B—C43—H43C110.00
F14'—P3'—F18'89.6 (12)O2—C44—C45120.0 (12)
F15'—P3'—F16'90.4 (10)O2—C44—C46122.8 (10)
F13'—P3'—F17'91.3 (11)C45—C44—C46117.1 (9)
F13'—P3'—F18'88.2 (11)C44—C45—H45A109.00
F14'—P3'—F15'91.2 (11)C44—C45—H45B109.00
F14'—P3'—F16'88.9 (11)C44—C45—H45C109.00
F17'—P3'—F18'88.2 (11)H45A—C45—H45B110.00
F15'—P3'—F18'92.3 (11)H45A—C45—H45C109.00
F16'—P3'—F17'89.1 (10)H45B—C45—H45C110.00
F15'—P3'—F17'179.4 (12)C44—C46—H46A109.00
F16'—P3'—F18'177.0 (13)C44—C46—H46B109.00
C17—N1—C19114.1 (3)C44—C46—H46C110.00
C18—N1—C19110.1 (3)H46A—C46—H46B109.00
C17—N1—C18104.8 (3)H46A—C46—H46C110.00
Ru3—C1—C269.4 (3)H46B—C46—H46C109.00
Ru3—C1—C1473.9 (2)O2'—C44'—C45'118 (5)
C2—C1—C14118.7 (4)O2'—C44'—C46'122 (4)
Ru3—C2—C371.6 (3)C45'—C44'—C46'119 (4)
C1—C2—C3120.8 (4)C44'—C45'—H45D109.00
Ru3—C2—C172.8 (2)C44'—C45'—H45E109.00
Ru3—C3—C271.1 (3)C44'—C45'—H45F110.00
Ru3—C3—C472.0 (3)H45D—C45'—H45E109.00
C2—C3—C4120.7 (4)H45D—C45'—H45F109.00
Ru3—C4—C370.4 (3)H45E—C45'—H45F110.00
C3—C4—C11119.1 (5)C44'—C46'—H46D109.00
Ru3—C4—C1173.7 (3)C44'—C46'—H46E109.00
Ru2—C5—C1272.4 (2)C44'—C46'—H46F110.00
C6—C5—C12118.9 (4)H46D—C46'—H46E109.00
Ru2—C5—C670.6 (2)H46D—C46'—H46F110.00
Ru2—C6—C572.0 (2)H46E—C46'—H46F110.00
C21—Ru1—C20—C19−116.4 (5)C13—Ru2—C35—C34−167.4 (3)
C21—Ru1—C20—C25132.4 (4)C31—Ru2—C35—C34117.5 (4)
C22—Ru1—C20—C19−146.2 (4)C32—Ru2—C35—C31−37.3 (3)
C22—Ru1—C20—C21−29.7 (3)C32—Ru2—C35—C3480.2 (3)
C22—Ru1—C20—C25102.7 (3)C33—Ru2—C35—C31−80.0 (3)
C23—Ru1—C20—C19176.4 (4)C33—Ru2—C35—C3437.5 (3)
C23—Ru1—C20—C21−67.2 (3)C34—Ru2—C35—C31−117.5 (4)
C23—Ru1—C20—C2565.3 (3)C2—Ru3—C1—C14−130.0 (4)
C24—Ru1—C20—C19140.0 (4)C3—Ru3—C1—C229.2 (3)
C24—Ru1—C20—C21−103.6 (3)C3—Ru3—C1—C14−100.8 (3)
C24—Ru1—C20—C2528.8 (3)C4—Ru3—C1—C266.2 (3)
C25—Ru1—C20—C19111.1 (5)C4—Ru3—C1—C14−63.8 (3)
C25—Ru1—C20—C21−132.4 (4)C11—Ru3—C1—C2102.3 (3)
C26—Ru1—C20—C19−32.7 (4)C11—Ru3—C1—C14−27.8 (2)
C26—Ru1—C20—C2183.7 (3)C14—Ru3—C1—C2130.0 (4)
C26—Ru1—C20—C25−143.9 (3)C36—Ru3—C1—C2−162.2 (5)
C27—Ru1—C20—C197.0 (4)C36—Ru3—C1—C1467.8 (5)
C27—Ru1—C20—C21123.4 (3)C38—Ru3—C1—C2−52.7 (6)
C27—Ru1—C20—C25−104.1 (3)C38—Ru3—C1—C14177.3 (5)
C28—Ru1—C20—C1943.4 (4)C39—Ru3—C1—C2−86.8 (4)
C28—Ru1—C20—C21159.9 (3)C39—Ru3—C1—C14143.2 (4)
C28—Ru1—C20—C25−67.7 (3)C40—Ru3—C1—C2−128.3 (5)
C30—Ru1—C20—C19−60.0 (6)C40—Ru3—C1—C14101.7 (5)
C30—Ru1—C20—C2156.5 (5)C1—Ru3—C2—C3131.9 (4)
C30—Ru1—C20—C25−171.1 (4)C3—Ru3—C2—C1−131.9 (4)
C20—Ru1—C21—C22−131.8 (4)C4—Ru3—C2—C1−103.0 (3)
C22—Ru1—C21—C20131.8 (4)C4—Ru3—C2—C328.9 (2)
C23—Ru1—C21—C20102.1 (3)C11—Ru3—C2—C1−66.1 (3)
C23—Ru1—C21—C22−29.7 (3)C11—Ru3—C2—C365.9 (3)
C24—Ru1—C21—C2065.6 (3)C14—Ru3—C2—C1−29.9 (2)
C24—Ru1—C21—C22−66.2 (3)C14—Ru3—C2—C3102.0 (3)
C25—Ru1—C21—C2028.9 (3)C37—Ru3—C2—C1173.1 (4)
C25—Ru1—C21—C22−102.9 (3)C37—Ru3—C2—C3−54.9 (5)
C26—Ru1—C21—C20−111.3 (3)C38—Ru3—C2—C1146.5 (4)
C26—Ru1—C21—C22116.9 (3)C38—Ru3—C2—C3−81.6 (4)
C27—Ru1—C21—C20−73.4 (3)C39—Ru3—C2—C1107.0 (4)
C27—Ru1—C21—C22154.9 (3)C39—Ru3—C2—C3−121.1 (4)
C29—Ru1—C21—C20−174.7 (4)C40—Ru3—C2—C173.5 (5)
C29—Ru1—C21—C2253.5 (5)C40—Ru3—C2—C3−154.5 (5)
C30—Ru1—C21—C20−150.2 (3)C1—Ru3—C3—C2−29.5 (2)
C30—Ru1—C21—C2278.1 (3)C1—Ru3—C3—C4103.2 (3)
C20—Ru1—C22—C2129.1 (3)C2—Ru3—C3—C4132.8 (4)
C20—Ru1—C22—C23−102.3 (3)C4—Ru3—C3—C2−132.8 (4)
C21—Ru1—C22—C23−131.4 (4)C11—Ru3—C3—C2−102.6 (3)
C23—Ru1—C22—C21131.4 (4)C11—Ru3—C3—C430.2 (3)
C24—Ru1—C22—C21102.8 (3)C14—Ru3—C3—C2−66.4 (3)
C24—Ru1—C22—C23−28.6 (3)C14—Ru3—C3—C466.4 (3)
C25—Ru1—C22—C2165.7 (3)C36—Ru3—C3—C2165.9 (5)
C25—Ru1—C22—C23−65.7 (3)C36—Ru3—C3—C4−61.3 (5)
C26—Ru1—C22—C21−79.5 (3)C37—Ru3—C3—C2147.3 (4)
C26—Ru1—C22—C23149.1 (3)C37—Ru3—C3—C4−80.0 (4)
C27—Ru1—C22—C21−54.5 (5)C38—Ru3—C3—C2109.6 (4)
C27—Ru1—C22—C23174.1 (4)C38—Ru3—C3—C4−117.7 (4)
C29—Ru1—C22—C21−156.3 (3)C39—Ru3—C3—C274.6 (4)
C29—Ru1—C22—C2372.3 (4)C39—Ru3—C3—C4−152.6 (4)
C30—Ru1—C22—C21−118.6 (3)C40—Ru3—C3—C266.2 (10)
C30—Ru1—C22—C23110.0 (3)C40—Ru3—C3—C4−161.0 (9)
C20—Ru1—C23—C2266.5 (3)C1—Ru3—C4—C3−66.1 (3)
C20—Ru1—C23—C24−65.9 (3)C1—Ru3—C4—C1163.9 (3)
C21—Ru1—C23—C2229.8 (3)C2—Ru3—C4—C3−28.8 (3)
C21—Ru1—C23—C24−102.7 (3)C2—Ru3—C4—C11101.2 (3)
C22—Ru1—C23—C24−132.5 (5)C3—Ru3—C4—C11130.0 (4)
C24—Ru1—C23—C22132.5 (5)C11—Ru3—C4—C3−130.0 (4)
C25—Ru1—C23—C22103.0 (3)C14—Ru3—C4—C3−101.9 (3)
C25—Ru1—C23—C24−29.5 (3)C14—Ru3—C4—C1128.1 (2)
C26—Ru1—C23—C22−57.6 (5)C36—Ru3—C4—C3149.6 (4)
C26—Ru1—C23—C24169.9 (4)C36—Ru3—C4—C11−80.5 (4)
C28—Ru1—C23—C22−161.0 (3)C37—Ru3—C4—C3113.5 (4)
C28—Ru1—C23—C2466.5 (4)C37—Ru3—C4—C11−116.5 (4)
C29—Ru1—C23—C22−124.9 (3)C38—Ru3—C4—C374.7 (4)
C29—Ru1—C23—C24102.6 (3)C38—Ru3—C4—C11−155.3 (4)
C30—Ru1—C23—C22−85.3 (3)C39—Ru3—C4—C354.2 (7)
C30—Ru1—C23—C24142.3 (3)C39—Ru3—C4—C11−175.8 (6)
C20—Ru1—C24—C23103.2 (3)C1—Ru3—C11—C4−105.4 (3)
C20—Ru1—C24—C25−28.6 (3)C1—Ru3—C11—C10133.2 (5)
C21—Ru1—C24—C2366.7 (3)C1—Ru3—C11—C1428.0 (2)
C21—Ru1—C24—C25−65.0 (3)C2—Ru3—C11—C4−67.8 (3)
C22—Ru1—C24—C2329.3 (3)C2—Ru3—C11—C10170.9 (5)
C22—Ru1—C24—C25−102.5 (3)C2—Ru3—C11—C1465.6 (3)
C23—Ru1—C24—C25−131.8 (5)C3—Ru3—C11—C4−30.6 (3)
C25—Ru1—C24—C23131.8 (5)C3—Ru3—C11—C10−152.0 (5)
C27—Ru1—C24—C23−164.6 (3)C3—Ru3—C11—C14102.8 (3)
C27—Ru1—C24—C2563.6 (4)C4—Ru3—C11—C10−121.4 (6)
C28—Ru1—C24—C23−131.6 (3)C4—Ru3—C11—C14133.4 (4)
C28—Ru1—C24—C2596.6 (3)C14—Ru3—C11—C4−133.4 (4)
C29—Ru1—C24—C23−90.8 (3)C14—Ru3—C11—C10105.3 (5)
C29—Ru1—C24—C25137.5 (3)C36—Ru3—C11—C4118.4 (5)
C30—Ru1—C24—C23−60.8 (5)C36—Ru3—C11—C10−3.0 (6)
C30—Ru1—C24—C25167.4 (3)C36—Ru3—C11—C14−108.2 (4)
C20—Ru1—C25—C24132.8 (4)C37—Ru3—C11—C477.2 (4)
C21—Ru1—C25—C20−28.9 (3)C37—Ru3—C11—C10−44.2 (6)
C21—Ru1—C25—C24103.9 (3)C37—Ru3—C11—C14−149.5 (4)
C22—Ru1—C25—C20−66.4 (3)C38—Ru3—C11—C444.1 (6)
C22—Ru1—C25—C2466.4 (3)C38—Ru3—C11—C10−77.3 (7)
C23—Ru1—C25—C20−103.7 (3)C38—Ru3—C11—C14177.4 (5)
C23—Ru1—C25—C2429.1 (3)C40—Ru3—C11—C4154.9 (5)
C24—Ru1—C25—C20−132.8 (4)C40—Ru3—C11—C1033.5 (7)
C26—Ru1—C25—C2059.7 (4)C40—Ru3—C11—C14−71.8 (5)
C26—Ru1—C25—C24−167.5 (3)C1—Ru3—C14—C9121.6 (5)
C27—Ru1—C25—C2089.8 (3)C1—Ru3—C14—C11−134.0 (4)
C27—Ru1—C25—C24−137.4 (3)C2—Ru3—C14—C130.8 (3)
C28—Ru1—C25—C20130.5 (3)C2—Ru3—C14—C9152.4 (4)
C28—Ru1—C25—C24−96.7 (3)C2—Ru3—C14—C11−103.2 (3)
C29—Ru1—C25—C20164.5 (3)C3—Ru3—C14—C168.1 (3)
C29—Ru1—C25—C24−62.7 (4)C3—Ru3—C14—C9−170.3 (4)
C20—Ru1—C26—C2784.6 (3)C3—Ru3—C14—C11−66.0 (3)
C20—Ru1—C26—C30−157.6 (3)C4—Ru3—C14—C1105.6 (3)
C21—Ru1—C26—C27123.4 (3)C4—Ru3—C14—C9−132.8 (4)
C21—Ru1—C26—C30−118.8 (3)C4—Ru3—C14—C11−28.5 (2)
C22—Ru1—C26—C27162.6 (3)C11—Ru3—C14—C1134.0 (4)
C22—Ru1—C26—C30−79.6 (4)C11—Ru3—C14—C9−104.4 (5)
C23—Ru1—C26—C27−160.8 (3)C36—Ru3—C14—C1−137.3 (5)
C23—Ru1—C26—C30−43.0 (5)C36—Ru3—C14—C9−15.7 (6)
C25—Ru1—C26—C2749.1 (4)C36—Ru3—C14—C1188.7 (5)
C25—Ru1—C26—C30167.0 (3)C37—Ru3—C14—C1−173.5 (4)
C27—Ru1—C26—C30117.8 (4)C37—Ru3—C14—C9−51.8 (6)
C28—Ru1—C26—C27−37.8 (3)C37—Ru3—C14—C1152.5 (5)
C28—Ru1—C26—C3080.0 (3)C39—Ru3—C14—C1−57.1 (5)
C29—Ru1—C26—C27−80.9 (3)C39—Ru3—C14—C964.5 (6)
C29—Ru1—C26—C3037.0 (3)C39—Ru3—C14—C11168.9 (5)
C30—Ru1—C26—C27−117.8 (4)C40—Ru3—C14—C1−95.2 (4)
C20—Ru1—C27—C26−110.9 (3)C40—Ru3—C14—C926.4 (6)
C20—Ru1—C27—C28131.6 (3)C40—Ru3—C14—C11130.8 (4)
C21—Ru1—C27—C26−73.7 (3)C1—Ru3—C36—C37174.4 (5)
C21—Ru1—C27—C28168.8 (2)C1—Ru3—C36—C4057.2 (7)
C22—Ru1—C27—C26−36.8 (5)C3—Ru3—C36—C37−28.0 (8)
C22—Ru1—C27—C28−154.2 (4)C3—Ru3—C36—C40−145.2 (7)
C24—Ru1—C27—C26174.0 (3)C4—Ru3—C36—C37−68.0 (6)
C24—Ru1—C27—C2856.6 (4)C4—Ru3—C36—C40174.9 (6)
C25—Ru1—C27—C26−150.0 (3)C11—Ru3—C36—C37−107.4 (5)
C25—Ru1—C27—C2892.5 (3)C11—Ru3—C36—C40135.4 (6)
C26—Ru1—C27—C28−117.5 (4)C14—Ru3—C36—C37−147.0 (5)
C28—Ru1—C27—C26117.5 (4)C14—Ru3—C36—C4095.9 (6)
C29—Ru1—C27—C2679.6 (3)C37—Ru3—C36—C40−117.2 (8)
C29—Ru1—C27—C28−37.8 (3)C38—Ru3—C36—C3737.2 (6)
C30—Ru1—C27—C2637.3 (3)C38—Ru3—C36—C40−80.0 (7)
C30—Ru1—C27—C28−80.1 (3)C39—Ru3—C36—C3779.5 (6)
C20—Ru1—C28—C27−66.4 (3)C39—Ru3—C36—C40−37.7 (6)
C20—Ru1—C28—C29176.2 (2)C40—Ru3—C36—C37117.2 (8)
C23—Ru1—C28—C27−177.5 (3)C2—Ru3—C37—C36−161.1 (5)
C23—Ru1—C28—C2965.1 (3)C2—Ru3—C37—C38−42.6 (8)
C24—Ru1—C28—C27−142.0 (3)C3—Ru3—C37—C36165.6 (5)
C24—Ru1—C28—C29100.7 (3)C3—Ru3—C37—C38−76.0 (6)
C25—Ru1—C28—C27−102.4 (3)C4—Ru3—C37—C36127.3 (5)
C25—Ru1—C28—C29140.2 (3)C4—Ru3—C37—C38−114.3 (6)
C26—Ru1—C28—C2737.4 (3)C11—Ru3—C37—C3690.1 (6)
C26—Ru1—C28—C29−80.0 (3)C11—Ru3—C37—C38−151.5 (6)
C27—Ru1—C28—C29−117.4 (4)C14—Ru3—C37—C3658.1 (7)
C29—Ru1—C28—C27117.4 (4)C14—Ru3—C37—C38176.5 (5)
C30—Ru1—C28—C2779.8 (3)C36—Ru3—C37—C38118.4 (8)
C30—Ru1—C28—C29−37.6 (3)C38—Ru3—C37—C36−118.4 (8)
C21—Ru1—C29—C28152.6 (4)C39—Ru3—C37—C36−80.5 (6)
C21—Ru1—C29—C3035.6 (6)C39—Ru3—C37—C3837.9 (6)
C22—Ru1—C29—C28−170.5 (3)C40—Ru3—C37—C36−37.6 (6)
C22—Ru1—C29—C3072.5 (4)C40—Ru3—C37—C3880.9 (7)
C23—Ru1—C29—C28−132.9 (3)C1—Ru3—C38—C37−174.1 (4)
C23—Ru1—C29—C30110.1 (3)C1—Ru3—C38—C39−57.7 (8)
C24—Ru1—C29—C28−94.0 (3)C2—Ru3—C38—C37154.4 (5)
C24—Ru1—C29—C30149.0 (3)C2—Ru3—C38—C39−89.2 (6)
C25—Ru1—C29—C28−58.7 (4)C3—Ru3—C38—C37116.5 (5)
C25—Ru1—C29—C30−175.7 (3)C3—Ru3—C38—C39−127.0 (6)
C26—Ru1—C29—C2880.0 (3)C4—Ru3—C38—C3779.6 (6)
C26—Ru1—C29—C30−37.0 (3)C4—Ru3—C38—C39−163.9 (5)
C27—Ru1—C29—C2837.7 (3)C11—Ru3—C38—C3751.9 (8)
C27—Ru1—C29—C30−79.3 (3)C11—Ru3—C38—C39168.4 (5)
C28—Ru1—C29—C30−117.0 (4)C36—Ru3—C38—C37−37.0 (6)
C30—Ru1—C29—C28117.0 (4)C36—Ru3—C38—C3979.4 (7)
C20—Ru1—C30—C2642.0 (5)C37—Ru3—C38—C39116.5 (8)
C20—Ru1—C30—C29160.3 (3)C39—Ru3—C38—C37−116.5 (8)
C21—Ru1—C30—C2677.8 (4)C40—Ru3—C38—C37−79.2 (6)
C21—Ru1—C30—C29−163.8 (3)C40—Ru3—C38—C3937.3 (7)
C22—Ru1—C30—C26116.8 (3)C1—Ru3—C39—C38143.5 (5)
C22—Ru1—C30—C29−124.8 (3)C1—Ru3—C39—C40−98.1 (6)
C23—Ru1—C30—C26156.5 (3)C2—Ru3—C39—C38103.9 (6)
C23—Ru1—C30—C29−85.1 (3)C2—Ru3—C39—C40−137.7 (6)
C24—Ru1—C30—C26−167.9 (3)C3—Ru3—C39—C3866.4 (6)
C24—Ru1—C30—C29−49.5 (5)C3—Ru3—C39—C40−175.2 (5)
C26—Ru1—C30—C29118.4 (5)C4—Ru3—C39—C3831.0 (10)
C27—Ru1—C30—C26−37.3 (3)C4—Ru3—C39—C40149.4 (6)
C27—Ru1—C30—C2981.1 (3)C14—Ru3—C39—C38176.6 (4)
C28—Ru1—C30—C26−80.2 (3)C14—Ru3—C39—C40−65.0 (8)
C28—Ru1—C30—C2938.2 (3)C36—Ru3—C39—C38−81.1 (7)
C29—Ru1—C30—C26−118.4 (5)C36—Ru3—C39—C4037.3 (7)
C6—Ru2—C5—C12130.5 (4)C37—Ru3—C39—C38−38.4 (6)
C7—Ru2—C5—C6−29.2 (2)C37—Ru3—C39—C4080.1 (7)
C7—Ru2—C5—C12101.3 (3)C38—Ru3—C39—C40118.4 (9)
C8—Ru2—C5—C6−66.2 (3)C40—Ru3—C39—C38−118.4 (9)
C8—Ru2—C5—C1264.3 (2)C1—Ru3—C40—C36−143.8 (5)
C12—Ru2—C5—C6−130.5 (4)C1—Ru3—C40—C3998.7 (6)
C13—Ru2—C5—C6−102.6 (3)C2—Ru3—C40—C36176.6 (4)
C13—Ru2—C5—C1227.9 (2)C2—Ru3—C40—C3959.1 (7)
C31—Ru2—C5—C6170.2 (3)C3—Ru3—C40—C36129.2 (9)
C31—Ru2—C5—C12−59.3 (4)C3—Ru3—C40—C3911.7 (13)
C33—Ru2—C5—C663.2 (3)C11—Ru3—C40—C36−65.0 (7)
C33—Ru2—C5—C12−166.4 (2)C11—Ru3—C40—C39177.4 (5)
C34—Ru2—C5—C699.2 (3)C14—Ru3—C40—C36−103.5 (6)
C34—Ru2—C5—C12−130.3 (2)C14—Ru3—C40—C39138.9 (5)
C35—Ru2—C5—C6140.1 (3)C36—Ru3—C40—C39−117.6 (9)
C35—Ru2—C5—C12−89.4 (3)C37—Ru3—C40—C3637.8 (6)
C5—Ru2—C6—C7−131.9 (4)C37—Ru3—C40—C39−79.7 (7)
C7—Ru2—C6—C5131.9 (4)C38—Ru3—C40—C3680.7 (6)
C8—Ru2—C6—C5103.1 (3)C38—Ru3—C40—C39−36.9 (6)
C8—Ru2—C6—C7−28.8 (2)C39—Ru3—C40—C36117.6 (9)
C12—Ru2—C6—C529.6 (2)C18—N1—C17—C1638.7 (4)
C12—Ru2—C6—C7−102.3 (3)C19—N1—C17—C16159.1 (3)
C13—Ru2—C6—C566.1 (2)C17—N1—C18—C15−39.4 (4)
C13—Ru2—C6—C7−65.8 (2)C19—N1—C18—C15−162.5 (3)
C32—Ru2—C6—C5−168.0 (3)C17—N1—C19—C2073.0 (5)
C32—Ru2—C6—C760.1 (3)C18—N1—C19—C20−169.6 (4)
C33—Ru2—C6—C5−135.7 (2)Ru3—C1—C2—C3−55.2 (4)
C33—Ru2—C6—C792.4 (3)C14—C1—C2—Ru357.0 (3)
C34—Ru2—C6—C5−95.2 (3)C14—C1—C2—C31.8 (6)
C34—Ru2—C6—C7132.9 (2)Ru3—C1—C14—C9−130.6 (4)
C35—Ru2—C6—C5−63.9 (3)Ru3—C1—C14—C1151.8 (3)
C35—Ru2—C6—C7164.2 (3)C2—C1—C14—Ru3−54.8 (3)
C5—Ru2—C7—C629.4 (2)C2—C1—C14—C9174.6 (4)
C5—Ru2—C7—C8−103.6 (3)C2—C1—C14—C11−3.1 (6)
C6—Ru2—C7—C8−133.0 (4)Ru3—C2—C3—C4−54.3 (4)
C8—Ru2—C7—C6133.0 (4)C1—C2—C3—Ru355.8 (4)
C12—Ru2—C7—C666.0 (2)C1—C2—C3—C41.5 (7)
C12—Ru2—C7—C8−67.0 (3)Ru3—C3—C4—C11−57.3 (3)
C13—Ru2—C7—C6102.9 (3)C2—C3—C4—Ru353.9 (4)
C13—Ru2—C7—C8−30.1 (2)C2—C3—C4—C11−3.4 (6)
C31—Ru2—C7—C6−168.3 (3)Ru3—C4—C11—C10130.1 (4)
C31—Ru2—C7—C858.7 (4)Ru3—C4—C11—C14−53.6 (3)
C32—Ru2—C7—C6−140.3 (2)C3—C4—C11—Ru355.7 (3)
C32—Ru2—C7—C886.7 (3)C3—C4—C11—C10−174.2 (4)
C33—Ru2—C7—C6−100.3 (3)C3—C4—C11—C142.1 (6)
C33—Ru2—C7—C8126.7 (3)Ru2—C5—C6—C754.9 (4)
C34—Ru2—C7—C6−67.0 (3)C12—C5—C6—Ru2−55.9 (3)
C34—Ru2—C7—C8160.0 (3)C12—C5—C6—C7−1.1 (6)
C5—Ru2—C8—C765.6 (3)Ru2—C5—C12—C10132.0 (4)
C5—Ru2—C8—C13−64.7 (3)Ru2—C5—C12—C13−52.1 (4)
C6—Ru2—C8—C728.6 (2)C6—C5—C12—Ru255.0 (3)
C6—Ru2—C8—C13−101.7 (3)C6—C5—C12—C10−173.0 (4)
C7—Ru2—C8—C13−130.2 (4)C6—C5—C12—C132.9 (6)
C12—Ru2—C8—C7101.2 (3)Ru2—C6—C7—C853.8 (4)
C12—Ru2—C8—C13−29.0 (2)C5—C6—C7—Ru2−55.1 (4)
C13—Ru2—C8—C7130.2 (4)C5—C6—C7—C8−1.3 (6)
C31—Ru2—C8—C7−145.1 (3)Ru2—C7—C8—C1355.5 (3)
C31—Ru2—C8—C1384.7 (3)C6—C7—C8—Ru2−53.7 (4)
C32—Ru2—C8—C7−106.4 (3)C6—C7—C8—C131.8 (6)
C32—Ru2—C8—C13123.4 (3)Ru2—C8—C13—C9−129.5 (4)
C33—Ru2—C8—C7−70.1 (3)Ru2—C8—C13—C1255.2 (4)
C33—Ru2—C8—C13159.7 (2)C7—C8—C13—Ru2−55.2 (3)
C35—Ru2—C8—C7−168.6 (3)C7—C8—C13—C9175.3 (4)
C35—Ru2—C8—C1361.2 (4)C7—C8—C13—C120.0 (6)
C5—Ru2—C12—C10−122.6 (5)C14—C9—C13—Ru233.1 (5)
C5—Ru2—C12—C13134.3 (4)C14—C9—C13—C8130.6 (4)
C6—Ru2—C12—C5−30.4 (2)C14—C9—C13—C12−53.8 (4)
C6—Ru2—C12—C10−153.0 (5)C15—C9—C13—Ru2148.5 (3)
C6—Ru2—C12—C13103.9 (3)C15—C9—C13—C8−114.1 (4)
C7—Ru2—C12—C5−67.5 (3)C15—C9—C13—C1261.6 (4)
C7—Ru2—C12—C10169.9 (4)C13—C9—C14—Ru3140.4 (3)
C7—Ru2—C12—C1366.8 (3)C13—C9—C14—C1−123.1 (4)
C8—Ru2—C12—C5−105.1 (3)C13—C9—C14—C1154.7 (4)
C8—Ru2—C12—C10132.3 (4)C15—C9—C14—Ru327.1 (5)
C8—Ru2—C12—C1329.2 (2)C15—C9—C14—C1123.6 (4)
C13—Ru2—C12—C5−134.3 (4)C15—C9—C14—C11−58.6 (4)
C13—Ru2—C12—C10103.1 (5)C13—C9—C15—C16−57.4 (4)
C31—Ru2—C12—C5146.9 (3)C13—C9—C15—C1860.3 (4)
C31—Ru2—C12—C1024.2 (5)C14—C9—C15—C1657.2 (4)
C31—Ru2—C12—C13−78.9 (3)C14—C9—C15—C18174.8 (3)
C32—Ru2—C12—C5176.6 (3)C12—C10—C11—Ru3−142.9 (4)
C32—Ru2—C12—C1053.9 (6)C12—C10—C11—C4121.0 (4)
C32—Ru2—C12—C13−49.2 (5)C12—C10—C11—C14−55.5 (4)
C34—Ru2—C12—C568.0 (3)C16—C10—C11—Ru3−29.2 (6)
C34—Ru2—C12—C10−54.6 (5)C16—C10—C11—C4−125.3 (4)
C34—Ru2—C12—C13−157.8 (2)C16—C10—C11—C1458.2 (4)
C35—Ru2—C12—C5106.5 (3)C11—C10—C12—Ru2−28.5 (5)
C35—Ru2—C12—C10−16.1 (5)C11—C10—C12—C5−127.6 (4)
C35—Ru2—C12—C13−119.2 (3)C11—C10—C12—C1356.2 (5)
C5—Ru2—C13—C8104.5 (3)C16—C10—C12—Ru2−144.1 (3)
C5—Ru2—C13—C9−133.3 (4)C16—C10—C12—C5116.8 (5)
C5—Ru2—C13—C12−27.6 (2)C16—C10—C12—C13−59.4 (4)
C6—Ru2—C13—C867.3 (3)C11—C10—C16—C15−55.2 (4)
C6—Ru2—C13—C9−170.5 (4)C11—C10—C16—C17−171.7 (4)
C6—Ru2—C13—C12−64.8 (3)C12—C10—C16—C1559.0 (4)
C7—Ru2—C13—C830.4 (3)C12—C10—C16—C17−57.6 (5)
C7—Ru2—C13—C9152.6 (4)Ru3—C11—C14—C1−51.0 (3)
C7—Ru2—C13—C12−101.7 (3)Ru3—C11—C14—C9131.0 (3)
C8—Ru2—C13—C9122.2 (5)C4—C11—C14—Ru352.2 (3)
C8—Ru2—C13—C12−132.1 (4)C4—C11—C14—C11.1 (6)
C12—Ru2—C13—C8132.1 (4)C4—C11—C14—C9−176.8 (3)
C12—Ru2—C13—C9−105.7 (4)C10—C11—C14—Ru3−131.1 (3)
C31—Ru2—C13—C8−110.6 (3)C10—C11—C14—C1177.9 (3)
C31—Ru2—C13—C911.6 (4)C10—C11—C14—C9−0.1 (4)
C31—Ru2—C13—C12117.3 (3)Ru2—C12—C13—C8−54.7 (3)
C32—Ru2—C13—C8−72.0 (3)Ru2—C12—C13—C9129.5 (3)
C32—Ru2—C13—C950.3 (4)C5—C12—C13—Ru252.3 (4)
C32—Ru2—C13—C12156.0 (2)C5—C12—C13—C8−2.4 (6)
C33—Ru2—C13—C8−47.3 (5)C5—C12—C13—C9−178.3 (4)
C33—Ru2—C13—C974.9 (6)C10—C12—C13—Ru2−131.3 (3)
C33—Ru2—C13—C12−179.4 (4)C10—C12—C13—C8174.1 (4)
C34—Ru2—C13—C8−171.3 (4)C10—C12—C13—C9−1.8 (5)
C34—Ru2—C13—C9−49.1 (7)C9—C15—C16—C10−1.1 (4)
C34—Ru2—C13—C1256.6 (5)C9—C15—C16—C17122.6 (3)
C35—Ru2—C13—C8−148.9 (3)C18—C15—C16—C10−124.6 (3)
C35—Ru2—C13—C9−26.7 (4)C18—C15—C16—C17−0.9 (4)
C35—Ru2—C13—C1279.0 (3)C9—C15—C18—N1−96.0 (4)
C5—Ru2—C31—C32−165.3 (3)C16—C15—C18—N124.2 (4)
C5—Ru2—C31—C35−47.6 (4)C10—C16—C17—N197.0 (4)
C7—Ru2—C31—C3245.4 (4)C15—C16—C17—N1−22.7 (4)
C7—Ru2—C31—C35163.2 (3)N1—C19—C20—Ru1108.0 (4)
C8—Ru2—C31—C3281.0 (3)N1—C19—C20—C2117.9 (6)
C8—Ru2—C31—C35−161.3 (3)N1—C19—C20—C25−164.7 (4)
C12—Ru2—C31—C32158.3 (3)Ru1—C20—C21—C2254.1 (4)
C12—Ru2—C31—C35−83.9 (3)C19—C20—C21—Ru1124.9 (4)
C13—Ru2—C31—C32120.1 (3)C19—C20—C21—C22179.0 (4)
C13—Ru2—C31—C35−122.2 (3)C25—C20—C21—Ru1−52.6 (4)
C32—Ru2—C31—C35117.8 (4)C25—C20—C21—C221.5 (7)
C33—Ru2—C31—C32−37.3 (3)Ru1—C20—C25—C24−54.2 (4)
C33—Ru2—C31—C3580.5 (3)C19—C20—C25—Ru1−125.3 (4)
C34—Ru2—C31—C32−80.0 (3)C19—C20—C25—C24−179.4 (4)
C34—Ru2—C31—C3537.8 (3)C21—C20—C25—Ru152.3 (4)
C35—Ru2—C31—C32−117.8 (4)C21—C20—C25—C24−1.9 (7)
C6—Ru2—C32—C31173.0 (3)Ru1—C21—C22—C2355.7 (4)
C6—Ru2—C32—C3354.8 (4)C20—C21—C22—Ru1−55.6 (4)
C7—Ru2—C32—C31−152.6 (3)C20—C21—C22—C230.1 (7)
C7—Ru2—C32—C3389.2 (3)Ru1—C22—C23—C2454.3 (4)
C8—Ru2—C32—C31−113.4 (3)C21—C22—C23—Ru1−55.7 (4)
C8—Ru2—C32—C33128.3 (3)C21—C22—C23—C24−1.4 (8)
C12—Ru2—C32—C31−44.4 (5)Ru1—C23—C24—C2554.5 (4)
C12—Ru2—C32—C33−162.6 (3)C22—C23—C24—Ru1−53.4 (4)
C13—Ru2—C32—C31−76.9 (3)C22—C23—C24—C251.1 (8)
C13—Ru2—C32—C33164.9 (2)Ru1—C24—C25—C2054.8 (4)
C31—Ru2—C32—C33−118.2 (4)C23—C24—C25—Ru1−54.2 (4)
C33—Ru2—C32—C31118.2 (4)C23—C24—C25—C200.6 (7)
C34—Ru2—C32—C3180.2 (3)Ru1—C26—C27—C2861.5 (3)
C34—Ru2—C32—C33−38.0 (3)C30—C26—C27—Ru1−62.0 (4)
C35—Ru2—C32—C3137.3 (3)C30—C26—C27—C28−0.5 (6)
C35—Ru2—C32—C33−80.9 (3)Ru1—C26—C30—C29−60.7 (4)
C5—Ru2—C33—C32−178.9 (2)C27—C26—C30—Ru161.5 (4)
C5—Ru2—C33—C3464.3 (3)C27—C26—C30—C290.8 (6)
C6—Ru2—C33—C32−143.7 (3)Ru1—C27—C28—C2962.2 (3)
C6—Ru2—C33—C3499.5 (3)C26—C27—C28—Ru1−62.2 (4)
C7—Ru2—C33—C32−104.6 (3)C26—C27—C28—C29−0.1 (5)
C7—Ru2—C33—C34138.6 (3)Ru1—C28—C29—C3062.8 (3)
C8—Ru2—C33—C32−67.9 (3)C27—C28—C29—Ru1−62.2 (3)
C8—Ru2—C33—C34175.3 (2)C27—C28—C29—C300.6 (5)
C13—Ru2—C33—C32−35.0 (5)Ru1—C29—C30—C2661.0 (4)
C13—Ru2—C33—C34−151.8 (4)C28—C29—C30—Ru1−61.8 (3)
C31—Ru2—C33—C3237.0 (3)C28—C29—C30—C26−0.8 (6)
C31—Ru2—C33—C34−79.8 (3)Ru2—C31—C32—C3361.9 (3)
C32—Ru2—C33—C34−116.8 (4)C35—C31—C32—Ru2−61.6 (3)
C34—Ru2—C33—C32116.8 (4)C35—C31—C32—C330.3 (5)
C35—Ru2—C33—C3279.2 (3)Ru2—C31—C35—C34−61.8 (3)
C35—Ru2—C33—C34−37.6 (3)C32—C31—C35—Ru261.1 (3)
C5—Ru2—C34—C33−135.1 (2)C32—C31—C35—C34−0.7 (5)
C5—Ru2—C34—C35107.2 (3)Ru2—C32—C33—C3462.7 (3)
C6—Ru2—C34—C33−95.1 (3)C31—C32—C33—Ru2−62.4 (3)
C6—Ru2—C34—C35147.2 (3)C31—C32—C33—C340.3 (5)
C7—Ru2—C34—C33−58.5 (3)Ru2—C33—C34—C3561.5 (3)
C7—Ru2—C34—C35−176.2 (3)C32—C33—C34—Ru2−62.2 (3)
C12—Ru2—C34—C33−170.9 (2)C32—C33—C34—C35−0.7 (5)
C12—Ru2—C34—C3571.4 (3)Ru2—C34—C35—C3162.0 (3)
C13—Ru2—C34—C33148.8 (4)C33—C34—C35—Ru2−61.1 (3)
C13—Ru2—C34—C3531.1 (6)C33—C34—C35—C310.8 (5)
C31—Ru2—C34—C3380.3 (3)Ru3—C36—C37—C38−60.9 (6)
C31—Ru2—C34—C35−37.3 (3)C40—C36—C37—Ru362.1 (5)
C32—Ru2—C34—C3338.0 (3)C40—C36—C37—C381.2 (9)
C32—Ru2—C34—C35−79.7 (3)Ru3—C36—C40—C3961.3 (6)
C33—Ru2—C34—C35−117.7 (4)C37—C36—C40—Ru3−62.0 (5)
C35—Ru2—C34—C33117.7 (4)C37—C36—C40—C39−0.7 (9)
C5—Ru2—C35—C31153.3 (2)Ru3—C37—C38—C39−62.4 (7)
C5—Ru2—C35—C34−89.2 (3)C36—C37—C38—Ru361.3 (6)
C6—Ru2—C35—C31−169.4 (3)C36—C37—C38—C39−1.2 (11)
C6—Ru2—C35—C34−51.9 (4)Ru3—C38—C39—C40−61.9 (7)
C8—Ru2—C35—C3135.7 (5)C37—C38—C39—Ru362.6 (7)
C8—Ru2—C35—C34153.2 (3)C37—C38—C39—C400.8 (12)
C12—Ru2—C35—C31114.0 (3)Ru3—C39—C40—C36−61.8 (6)
C12—Ru2—C35—C34−128.5 (3)C38—C39—C40—Ru361.7 (8)
C13—Ru2—C35—C3175.1 (3)C38—C39—C40—C36−0.1 (11)
Hydrogen-bond geometry (Å, º)
Cg1 is the centroid of the C20–C25 ring and Cg2 is the centroid of the C26–C30 ring.
D—H···AD—HH···AD···AD—H···A
C2—H2···O2i0.952.563.188 (8)124
C3—H3···O2i0.952.583.197 (7)123
C7—H7···F7ii0.952.503.359 (5)150
C8—H8···F9iii0.952.423.302 (6)155
C16—H16···O11.002.463.240 (6)134
C18—H18A···F12iii0.992.523.398 (5)147
C22—H22···F11iv0.952.433.091 (6)127
C27—H27···O2v0.952.503.141 (9)125
C29—H29···F6ii0.952.483.155 (7)128
C43—H43C···F4iv0.982.313.287 (9)176
C46′—H46D···Cg10.982.793.63 (5)160
C32—H32···Cg2vi0.952.433.669 (5)136
Symmetry codes: (i) x−1, y, z−1; (ii) −x+1/2, y+1/2, −z+3/2; (iii) x−1/2, −y+1/2, z−1/2; (iv) x+1/2, −y+1/2, z−1/2; (v) x−1, y, z; (vi) −x, −y+1, −z+1.
Footnotes
Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: SU2499).
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