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Acta Crystallogr Sect E Struct Rep Online. 2009 July 1; 65(Pt 7): m840–m841.
Published online 2009 June 27. doi:  10.1107/S160053680902399X
PMCID: PMC2969449

(Acetone-2κO){μ-6,6′-dimeth­oxy-2,2′-[propane-1,2-diylbis(nitrilo­methyl­idyne)]diphenolato-κ81:2O 6,O 1,O 1′,O 6′:O 1,N,N′,O 1′}tris­(nitrato-1κ2 O,O′)copper(II)samarium(III)

Abstract

In the title heteronuclear complex, [CuSm(C19H20N2O4)(NO3)3(CH3COCH3)], the CuII ion is five-coordinated by two O and two N atoms from the 6,6′-dimeth­oxy-2,2′-[propane-1,2-diylbis(nitrilo­methyl­idyne)]diphenolate ligand (L) and by an O atom from the acetone mol­ecule in a square-pyramidal geometry. The SmIII ion is ten-coordinated by six O atoms from the three nitrate ligands and four O atoms from the L ligand. In L, the C atoms of the diamino­propane fragment are disordered over two positions in a 0.674 (10):0.326 (10) ratio.

Related literature

For similar Cu–Ln (Ln = Gd, Pr and Tb) dinuclear complexes of the N,N′-bis­(3-methoxy­salicyl­idene)propane-1,2-diamine ligand, see: Kara et al. (2000 [triangle]); Sun et al. (2007 [triangle], 2009 [triangle]).

An external file that holds a picture, illustration, etc.
Object name is e-65-0m840-scheme1.jpg

Experimental

Crystal data

  • [CuSm(C19H20N2O4)(NO3)3(C3H6O)]
  • M r = 797.38
  • Monoclinic, An external file that holds a picture, illustration, etc.
Object name is e-65-0m840-efi1.jpg
  • a = 9.882 (4) Å
  • b = 18.868 (5) Å
  • c = 15.631 (5) Å
  • β = 95.320 (16)°
  • V = 2901.9 (16) Å3
  • Z = 4
  • Mo Kα radiation
  • μ = 2.81 mm−1
  • T = 291 K
  • 0.39 × 0.33 × 0.29 mm

Data collection

  • Rigaku R-AXIS RAPID diffractometer
  • Absorption correction: multi-scan (ABSCOR; Higashi, 1995 [triangle]) T min = 0.404, T max = 0.500 (expected range = 0.357–0.442)
  • 28125 measured reflections
  • 6634 independent reflections
  • 5584 reflections with I > 2σ(I)
  • R int = 0.031

Refinement

  • R[F 2 > 2σ(F 2)] = 0.033
  • wR(F 2) = 0.088
  • S = 1.07
  • 6634 reflections
  • 421 parameters
  • 36 restraints
  • H-atom parameters constrained
  • Δρmax = 1.03 e Å−3
  • Δρmin = −0.74 e Å−3

Data collection: RAPID-AUTO (Rigaku, 1998 [triangle]); cell refinement: RAPID-AUTO; data reduction: CrystalStructure (Rigaku/MSC, 2002 [triangle]); 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: SHELXL97.

Supplementary Material

Crystal structure: contains datablocks I, global. DOI: 10.1107/S160053680902399X/cv2575sup1.cif

Structure factors: contains datablocks I. DOI: 10.1107/S160053680902399X/cv2575Isup2.hkl

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

Acknowledgments

The authors gratefully acknowledge financial support from the National Natural Science Foundation of China (grant Nos. 20572018 and 20672032), Heilongjiang Province (grant Nos. 11531284, 1055HZ001, ZJG0504 and JC200605) and Heilongjiang University (grant Nos. 09k137, 09k117 and 09k118).

supplementary crystallographic information

Comment

In continuation of our study of heteronuclear complexes of N,N'-bis(3- methoxysalicylidene)propane-1,2-diamine ligand (Sun et al., 2007, 2009), we present here the crystal structure of the title compound. As shown in Fig. 1, ligand L links Cu and Sm atoms into a dinuclear complex through two phenolate O atoms, and the SmIII centre in the complex is ten-coordinated by four oxygen atoms from L and six oxygen atoms from three nitrato ions. The CuII center is five-coordinate by two nitrogen atoms and two oxygen atoms from the ligand and one oxygen atom from acetone in a square-pyramidal geometry. The title compound is isostructural with the previous Cu—Ln complexes (Ln = Gd, Pr and Tb) (Kara et al., 2000; Sun et al., 2007, 2009) derived from the same ligand.

Experimental

To a 1:1 MeOH/Me2CO solution (20 ml) of the Schiff ligand (0.086 g, 0.250 mmol) was slowly added an aqueous solution (8 ml) of [Cu(Ac)2H2O] (0.050 g, 0.25 mmol), after refluxing and stirring for 3 h, was slowly added a MeOH solution (10 ml) of Sm(NO3)36H2O (0.105 g, 0.25 mmol) at ambient temperature. After stirring for 5 h, red solid was collected by filtration and washed with MeOH, [CuSm(C19H20N2O4)(CH3COCH3)(NO3)3], yield 0.180 g (87%). Single crystals suitable for X-ray determination were obtained by slow diffusion of diethylether into a methanol solution of the powder sample over one week. Analysis calculated for C22H26CuN5O14Sm: C, 33.10; H, 3.28; N, 8.77; found: C, 33.01; H, 3.31; N, 8.92%.

Refinement

H atoms bound to C atoms were placed in calculated positions and treated as riding on their parent atoms, with C—H = 0.93 Å (aromatic C), C—H = 0.98 Å (methylene C), C—H = 0.96 Å (methly C) and with Uiso(H) = 1.2Ueq(C). The C atoms of the diaminopropane fragment were treated as disordered over two positions with the occupancy factors refined to 0.674 (10) and 0.326 (10), respectively.

Figures

Fig. 1.
The molecular structure of the title compound showing the atomic numbering and 40% probability displacement ellipsoids. Only major part of the disordered fragment is shown.

Crystal data

[CuSm(C19H20N2O4)(NO3)3(C3H6O)]F(000) = 1580
Mr = 797.38Dx = 1.825 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybcCell parameters from 23031 reflections
a = 9.882 (4) Åθ = 3.0–27.5°
b = 18.868 (5) ŵ = 2.81 mm1
c = 15.631 (5) ÅT = 291 K
β = 95.320 (16)°Block, brown
V = 2901.9 (16) Å30.39 × 0.33 × 0.29 mm
Z = 4

Data collection

Rigaku R-AXIS RAPID diffractometer6634 independent reflections
Radiation source: fine-focus sealed tube5584 reflections with I > 2σ(I)
graphiteRint = 0.031
ω scansθmax = 27.5°, θmin = 3.0°
Absorption correction: multi-scan (ABSCOR; Higashi, 1995)h = −12→12
Tmin = 0.404, Tmax = 0.500k = −24→24
28125 measured reflectionsl = −19→20

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)] = 0.033Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.088H-atom parameters constrained
S = 1.07w = 1/[σ2(Fo2) + (0.0469P)2 + 1.8845P] where P = (Fo2 + 2Fc2)/3
6634 reflections(Δ/σ)max = 0.006
421 parametersΔρmax = 1.02 e Å3
36 restraintsΔρmin = −0.74 e Å3

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*/UeqOcc. (<1)
C8'0.1263 (19)0.1131 (8)0.6707 (10)0.071 (4)0.326 (10)
H4'0.03590.12130.68970.086*0.326 (10)
C9'0.145 (3)0.0470 (10)0.6393 (18)0.150 (11)0.326 (10)
H5A0.13100.04790.57780.225*0.326 (10)
H6A0.08170.01490.66150.225*0.326 (10)
H7A0.23620.03150.65660.225*0.326 (10)
C10'0.1389 (17)0.1317 (7)0.5793 (11)0.051 (4)0.326 (10)
H8A0.07010.10720.54210.061*0.326 (10)
H9A0.22770.11820.56310.061*0.326 (10)
C80.1982 (10)0.1147 (4)0.6338 (6)0.075 (2)0.674 (10)
H40.17150.06910.65690.091*0.674 (10)
C90.2955 (13)0.1009 (7)0.5751 (7)0.129 (4)0.674 (10)
H50.30490.14180.53970.193*0.674 (10)
H60.26630.06120.53960.193*0.674 (10)
H70.38150.09020.60620.193*0.674 (10)
C100.0731 (13)0.1457 (5)0.5815 (8)0.096 (4)0.674 (10)
H80.05450.12160.52680.115*0.674 (10)
H9−0.00690.14370.61300.115*0.674 (10)
Sm10.28473 (2)0.426361 (8)0.751802 (10)0.03909 (7)
Cu0.20496 (6)0.25917 (2)0.67412 (3)0.05590 (14)
O10.3107 (3)0.30109 (12)0.76905 (17)0.0528 (7)
O20.4514 (3)0.37744 (13)0.87833 (16)0.0527 (7)
O30.1956 (3)0.35392 (13)0.63401 (16)0.0525 (7)
O40.2338 (3)0.48443 (14)0.59859 (16)0.0512 (6)
O50.4888 (3)0.39591 (16)0.6739 (2)0.0659 (8)
O60.6496 (5)0.4695 (2)0.6546 (3)0.1085 (16)
O70.4919 (3)0.49733 (14)0.7349 (2)0.0609 (7)
O80.2232 (4)0.55708 (17)0.7635 (2)0.0720 (10)
O90.2694 (5)0.62299 (18)0.8738 (3)0.1104 (17)
O100.3179 (5)0.51210 (16)0.87669 (19)0.0808 (11)
O110.1305 (5)0.3903 (3)0.8594 (3)0.0988 (13)
O12−0.0836 (5)0.4062 (3)0.8508 (4)0.132 (2)
O130.0338 (4)0.4383 (2)0.7491 (3)0.0904 (12)
O14−0.0249 (4)0.25774 (19)0.7448 (2)0.0749 (9)
N10.2387 (5)0.16408 (19)0.7111 (3)0.0851 (14)
N20.1181 (5)0.2182 (2)0.5703 (3)0.0780 (13)
N30.5473 (4)0.45422 (18)0.6863 (2)0.0566 (8)
N40.2711 (4)0.56584 (17)0.8385 (2)0.0606 (10)
N50.0199 (5)0.4123 (2)0.8212 (3)0.0754 (12)
C10.3693 (4)0.26602 (18)0.8360 (3)0.0465 (8)
C20.4440 (4)0.30587 (19)0.8984 (2)0.0494 (9)
C30.5035 (5)0.2754 (3)0.9723 (3)0.0700 (13)
H10.55250.30281.01380.084*
C40.4889 (6)0.2021 (3)0.9838 (4)0.0815 (16)
H20.52520.18091.03460.098*
C50.4224 (5)0.1622 (2)0.9217 (4)0.0770 (15)
H30.41640.11350.92980.092*
C60.3628 (4)0.1918 (2)0.8460 (3)0.0559 (10)
C70.3007 (5)0.1443 (2)0.7817 (4)0.0759 (15)
C110.0826 (6)0.2515 (3)0.5020 (3)0.0829 (16)
H100.04420.22530.45550.099*
C120.0966 (5)0.3270 (3)0.4898 (3)0.0638 (12)
C130.0536 (5)0.3555 (4)0.4084 (3)0.0800 (16)
H110.01410.32580.36560.096*
C140.0686 (6)0.4248 (3)0.3915 (3)0.0792 (16)
H120.03770.44230.33750.095*
C150.1281 (5)0.4698 (3)0.4517 (2)0.0652 (12)
H130.13980.51740.43870.078*
C160.1710 (4)0.4441 (2)0.5324 (2)0.0508 (9)
C170.1542 (4)0.3732 (2)0.5535 (2)0.0511 (9)
C180.2810 (6)0.5531 (2)0.5755 (3)0.0662 (12)
H140.20460.58250.55690.099*
H150.33880.54840.52980.099*
H160.33110.57440.62450.099*
C190.5576 (6)0.4172 (2)0.9257 (3)0.0725 (14)
H170.56950.46160.89750.109*
H180.64090.39070.92830.109*
H190.53350.42570.98290.109*
C20−0.2540 (7)0.2557 (4)0.7781 (5)0.108 (2)
H20−0.30300.29830.78860.162*
H21−0.21610.23620.83190.162*
H22−0.31490.22180.74930.162*
C21−0.1422 (5)0.2722 (2)0.7232 (3)0.0635 (11)
C22−0.1820 (6)0.3064 (3)0.6394 (4)0.0856 (16)
H23−0.24820.34260.64670.128*
H24−0.22030.27150.59950.128*
H25−0.10350.32720.61770.128*

Atomic displacement parameters (Å2)

U11U22U33U12U13U23
C8'0.072 (5)0.071 (5)0.072 (5)−0.0003 (10)0.0066 (11)−0.0003 (10)
C9'0.158 (14)0.134 (13)0.159 (14)−0.015 (9)0.018 (9)0.004 (9)
C10'0.056 (7)0.029 (5)0.069 (7)−0.006 (5)0.015 (6)−0.023 (5)
C80.077 (2)0.073 (2)0.076 (2)−0.0005 (10)0.0069 (10)−0.0024 (10)
C90.129 (5)0.128 (4)0.129 (4)0.0003 (10)0.0126 (11)−0.0001 (10)
C100.101 (9)0.075 (6)0.107 (7)0.005 (6)−0.011 (7)−0.049 (5)
Sm10.04727 (12)0.03289 (10)0.03616 (10)−0.00080 (7)−0.00128 (7)−0.00168 (6)
Cu0.0668 (3)0.0395 (2)0.0598 (3)−0.0081 (2)−0.0022 (2)−0.0138 (2)
O10.0649 (19)0.0321 (11)0.0580 (15)−0.0026 (11)−0.0123 (13)0.0002 (10)
O20.0618 (18)0.0416 (12)0.0507 (14)−0.0020 (12)−0.0166 (13)0.0029 (11)
O30.0677 (19)0.0485 (14)0.0396 (13)−0.0129 (13)−0.0046 (12)−0.0065 (10)
O40.0583 (17)0.0523 (14)0.0421 (13)−0.0003 (12)−0.0003 (12)0.0079 (11)
O50.065 (2)0.0495 (15)0.085 (2)−0.0083 (14)0.0213 (17)−0.0209 (15)
O60.092 (3)0.073 (2)0.172 (4)−0.019 (2)0.074 (3)−0.014 (3)
O70.0613 (19)0.0437 (14)0.0786 (19)−0.0055 (13)0.0112 (15)−0.0144 (13)
O80.099 (3)0.0538 (16)0.0581 (17)0.0220 (17)−0.0187 (17)−0.0100 (13)
O90.175 (5)0.0548 (19)0.092 (3)0.032 (2)−0.038 (3)−0.0323 (18)
O100.134 (3)0.0544 (17)0.0495 (16)0.0307 (19)−0.0160 (18)−0.0106 (13)
O110.080 (3)0.139 (4)0.081 (3)0.004 (3)0.028 (2)0.038 (3)
O120.087 (3)0.167 (5)0.151 (5)0.000 (3)0.069 (4)−0.007 (4)
O130.061 (2)0.117 (3)0.093 (3)0.005 (2)0.008 (2)0.022 (2)
O140.060 (2)0.082 (2)0.082 (2)0.0122 (17)0.0029 (18)0.0157 (17)
N10.091 (3)0.0357 (18)0.124 (4)−0.0006 (19)−0.016 (3)−0.015 (2)
N20.093 (3)0.071 (2)0.070 (3)−0.030 (2)0.010 (2)−0.036 (2)
N30.056 (2)0.0450 (17)0.070 (2)−0.0027 (16)0.0151 (18)0.0000 (16)
N40.078 (3)0.0443 (17)0.057 (2)0.0107 (16)−0.0078 (19)−0.0121 (14)
N50.070 (3)0.074 (3)0.087 (3)−0.008 (2)0.032 (3)−0.007 (2)
C10.043 (2)0.0379 (17)0.059 (2)0.0019 (14)0.0029 (17)0.0066 (15)
C20.044 (2)0.0475 (19)0.055 (2)0.0063 (16)−0.0028 (17)0.0117 (16)
C30.067 (3)0.068 (3)0.071 (3)0.003 (2)−0.016 (2)0.015 (2)
C40.072 (3)0.074 (3)0.095 (4)0.007 (3)−0.011 (3)0.044 (3)
C50.054 (3)0.050 (2)0.126 (5)0.004 (2)0.001 (3)0.033 (3)
C60.041 (2)0.0401 (18)0.086 (3)0.0040 (16)0.004 (2)0.0095 (18)
C70.062 (3)0.0345 (19)0.129 (5)0.0030 (19)−0.003 (3)0.000 (2)
C110.087 (4)0.105 (4)0.056 (3)−0.030 (3)0.004 (3)−0.038 (3)
C120.054 (3)0.092 (3)0.045 (2)−0.011 (2)0.0046 (18)−0.021 (2)
C130.062 (3)0.133 (5)0.042 (2)−0.006 (3)−0.007 (2)−0.023 (3)
C140.060 (3)0.135 (5)0.041 (2)0.010 (3)−0.005 (2)0.000 (3)
C150.054 (3)0.100 (3)0.042 (2)0.015 (2)0.0065 (19)0.009 (2)
C160.045 (2)0.072 (2)0.0357 (17)0.0054 (18)0.0040 (15)0.0003 (16)
C170.047 (2)0.071 (2)0.0347 (17)−0.0033 (18)0.0016 (15)−0.0089 (16)
C180.077 (3)0.059 (2)0.063 (3)−0.004 (2)0.009 (2)0.019 (2)
C190.079 (3)0.056 (2)0.075 (3)−0.011 (2)−0.033 (3)−0.001 (2)
C200.077 (4)0.131 (6)0.122 (5)−0.005 (4)0.033 (4)0.010 (5)
C210.055 (3)0.058 (2)0.078 (3)0.003 (2)0.006 (2)−0.001 (2)
C220.065 (3)0.092 (4)0.097 (4)0.017 (3)−0.005 (3)0.012 (3)

Geometric parameters (Å, °)

C8'—C9'1.358 (10)O8—N41.234 (4)
C8'—C10'1.49 (2)O9—N41.212 (4)
C8'—N11.559 (17)O10—N41.243 (4)
C8'—H4'0.9800O11—N51.266 (6)
C9'—H5A0.9600O12—N51.166 (5)
C9'—H6A0.9600O13—N51.249 (6)
C9'—H7A0.9600O14—C211.208 (6)
C10'—N21.648 (15)N1—C71.267 (7)
C10'—H8A0.9700N2—C111.261 (7)
C10'—H9A0.9700C1—C21.388 (5)
C8—C91.414 (9)C1—C61.412 (5)
C8—C101.533 (15)C2—C31.373 (5)
C8—N11.549 (9)C3—C41.405 (7)
C8—H40.9800C3—H10.9300
C9—H50.9600C4—C51.350 (8)
C9—H60.9600C4—H20.9300
C9—H70.9600C5—C61.389 (6)
C10—N21.455 (12)C5—H30.9300
C10—H80.9700C6—C71.441 (7)
C10—H90.9700C11—C121.444 (8)
Sm1—O12.390 (2)C11—H100.9300
Sm1—O32.394 (2)C12—C171.404 (5)
Sm1—O112.467 (4)C12—C131.410 (7)
Sm1—O72.481 (3)C13—C141.346 (8)
Sm1—O132.486 (4)C13—H110.9300
Sm1—O52.517 (3)C14—C151.361 (7)
Sm1—O102.533 (3)C14—H120.9300
Sm1—O82.551 (3)C15—C161.380 (5)
Sm1—O22.621 (3)C15—H130.9300
Sm1—O42.639 (3)C16—C171.392 (6)
Sm1—Cu3.4452 (9)C18—H140.9600
Cu—O31.894 (3)C18—H150.9600
Cu—N11.905 (4)C18—H160.9600
Cu—O11.906 (3)C19—H170.9600
Cu—N21.926 (4)C19—H180.9600
Cu—O142.616 (4)C19—H190.9600
O1—C11.325 (4)C20—C211.495 (8)
O2—C21.390 (4)C20—H200.9600
O2—C191.438 (5)C20—H210.9600
O3—C171.337 (4)C20—H220.9600
O4—C161.384 (5)C21—C221.479 (7)
O4—C181.435 (5)C22—H230.9600
O5—N31.250 (5)C22—H240.9600
O6—N31.202 (5)C22—H250.9600
O7—N31.271 (4)
C9'—C8'—C10'81.1 (16)C2—O2—Sm1118.0 (2)
C9'—C8'—N1126.6 (19)C19—O2—Sm1125.6 (2)
C10'—C8'—N197.1 (12)C17—O3—Cu124.7 (2)
C9'—C8'—H4'114.5C17—O3—Sm1128.8 (2)
C10'—C8'—H4'114.5Cu—O3—Sm1106.33 (11)
N1—C8'—H4'114.5C16—O4—C18116.3 (3)
C8'—C9'—H5A109.4C16—O4—Sm1119.0 (2)
C8'—C9'—H6A109.4C18—O4—Sm1124.3 (2)
H5A—C9'—H6A109.5N3—O5—Sm196.0 (2)
C8'—C9'—H7A109.6N3—O7—Sm197.1 (2)
H5A—C9'—H7A109.5N4—O8—Sm197.2 (2)
H6A—C9'—H7A109.5N4—O10—Sm197.8 (2)
C8'—C10'—N2107.2 (10)N5—O11—Sm198.6 (3)
C8'—C10'—H8A110.3N5—O13—Sm198.2 (3)
N2—C10'—H8A110.3C21—O14—Cu136.6 (3)
C8'—C10'—H9A110.3C7—N1—C8124.8 (5)
N2—C10'—H9A110.3C7—N1—C8'116.1 (7)
H8A—C10'—H9A108.5C8—N1—C8'35.8 (6)
C9—C8—C10106.7 (10)C7—N1—Cu126.8 (3)
C9—C8—N1118.4 (8)C8—N1—Cu107.7 (4)
C10—C8—N1109.0 (6)C8'—N1—Cu111.1 (6)
C9—C8—H4107.4C11—N2—C10120.5 (6)
C10—C8—H4107.4C11—N2—C10'126.1 (7)
N1—C8—H4107.4C10—N2—C10'25.3 (6)
N2—C10—C8100.5 (8)C11—N2—Cu125.5 (3)
N2—C10—H8111.7C10—N2—Cu113.2 (5)
C8—C10—H8111.7C10'—N2—Cu106.4 (7)
N2—C10—H9111.7O6—N3—O5122.8 (4)
C8—C10—H9111.7O6—N3—O7121.2 (4)
H8—C10—H9109.4O5—N3—O7115.9 (3)
O1—Sm1—O363.26 (9)O9—N4—O8122.1 (4)
O1—Sm1—O1173.56 (14)O9—N4—O10121.8 (4)
O3—Sm1—O1199.22 (14)O8—N4—O10116.1 (3)
O1—Sm1—O7117.70 (10)O12—N5—O13124.8 (6)
O3—Sm1—O7118.33 (10)O12—N5—O11122.1 (6)
O11—Sm1—O7142.13 (14)O13—N5—O11113.1 (4)
O1—Sm1—O13100.85 (12)O1—C1—C2116.7 (3)
O3—Sm1—O1375.16 (13)O1—C1—C6124.2 (4)
O11—Sm1—O1350.10 (14)C2—C1—C6119.1 (4)
O7—Sm1—O13141.33 (11)C3—C2—C1121.5 (4)
O1—Sm1—O575.31 (10)C3—C2—O2124.7 (4)
O3—Sm1—O575.62 (10)C1—C2—O2113.8 (3)
O11—Sm1—O5147.14 (14)C2—C3—C4118.7 (5)
O7—Sm1—O550.62 (9)C2—C3—H1120.7
O13—Sm1—O5148.77 (13)C4—C3—H1120.7
O1—Sm1—O10122.67 (9)C5—C4—C3120.4 (4)
O3—Sm1—O10165.75 (12)C5—C4—H2119.8
O11—Sm1—O1072.23 (16)C3—C4—H2119.8
O7—Sm1—O1071.85 (12)C4—C5—C6121.9 (4)
O13—Sm1—O1090.71 (15)C4—C5—H3119.1
O5—Sm1—O10117.81 (13)C6—C5—H3119.1
O1—Sm1—O8166.37 (12)C5—C6—C1118.3 (4)
O3—Sm1—O8122.28 (10)C5—C6—C7117.6 (4)
O11—Sm1—O892.93 (15)C1—C6—C7124.1 (4)
O7—Sm1—O871.98 (12)N1—C7—C6124.4 (4)
O13—Sm1—O870.68 (14)N2—C11—C12125.5 (4)
O5—Sm1—O8117.56 (12)N2—C11—H10117.2
O10—Sm1—O848.83 (10)C12—C11—H10117.2
O1—Sm1—O260.88 (8)C17—C12—C13118.1 (5)
O3—Sm1—O2122.66 (9)C17—C12—C11123.8 (4)
O11—Sm1—O276.89 (13)C13—C12—C11118.1 (4)
O7—Sm1—O278.67 (10)C14—C13—C12121.2 (5)
O13—Sm1—O2126.90 (12)C14—C13—H11119.4
O5—Sm1—O279.01 (11)C12—C13—H11119.4
O10—Sm1—O267.43 (9)C13—C14—C15121.3 (5)
O8—Sm1—O2115.05 (9)C13—C14—H12119.4
O1—Sm1—O4121.49 (9)C15—C14—H12119.4
O3—Sm1—O460.90 (9)C14—C15—C16119.3 (5)
O11—Sm1—O4130.92 (13)C14—C15—H13120.3
O7—Sm1—O476.65 (10)C16—C15—H13120.3
O13—Sm1—O480.85 (12)C15—C16—O4124.6 (4)
O5—Sm1—O475.50 (11)C15—C16—C17121.4 (4)
O10—Sm1—O4115.74 (9)O4—C16—C17114.0 (3)
O8—Sm1—O468.73 (9)O3—C17—C16116.8 (3)
O2—Sm1—O4152.18 (10)O3—C17—C12124.6 (4)
O1—Sm1—Cu32.10 (6)C16—C17—C12118.6 (4)
O3—Sm1—Cu31.84 (6)O4—C18—H14109.5
O11—Sm1—Cu81.50 (12)O4—C18—H15109.5
O7—Sm1—Cu128.37 (6)H14—C18—H15109.5
O13—Sm1—Cu83.23 (11)O4—C18—H16109.5
O5—Sm1—Cu77.75 (7)H14—C18—H16109.5
O10—Sm1—Cu149.93 (8)H15—C18—H16109.5
O8—Sm1—Cu149.58 (8)O2—C19—H17109.5
O2—Sm1—Cu92.91 (6)O2—C19—H18109.5
O4—Sm1—Cu92.42 (6)H17—C19—H18109.5
O3—Cu—N1172.44 (19)O2—C19—H19109.5
O3—Cu—O182.66 (11)H17—C19—H19109.5
N1—Cu—O194.96 (16)H18—C19—H19109.5
O3—Cu—N295.50 (16)C21—C20—H20109.5
N1—Cu—N286.0 (2)C21—C20—H21109.5
O1—Cu—N2172.76 (17)H20—C20—H21109.5
O3—Cu—O1497.58 (12)C21—C20—H22109.5
N1—Cu—O1489.80 (18)H20—C20—H22109.5
O1—Cu—O1496.32 (13)H21—C20—H22109.5
N2—Cu—O1490.86 (17)O14—C21—C22121.1 (5)
O3—Cu—Sm141.83 (7)O14—C21—C20122.2 (5)
N1—Cu—Sm1136.67 (14)C22—C21—C20116.7 (5)
O1—Cu—Sm141.80 (7)C21—C22—H23109.5
N2—Cu—Sm1137.23 (14)C21—C22—H24109.5
O14—Cu—Sm192.28 (8)H23—C22—H24109.5
C1—O1—Cu125.1 (2)C21—C22—H25109.5
C1—O1—Sm1128.1 (2)H23—C22—H25109.5
Cu—O1—Sm1106.11 (11)H24—C22—H25109.5
C2—O2—C19116.2 (3)

Footnotes

Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: CV2575).

References

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  • Sun, W.-B., Gao, T., Yan, P.-F., Li, G.-M. & Hou, G.-F. (2007). Acta Cryst. E63, m2192.
  • Sun, W.-B., Yan, P.-F., Li, G.-M. & Hou, G.-F. (2009). Acta Cryst. E65, m780–m781. [PMC free article] [PubMed]

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