Download citation
Download citation
link to html
The title compound, [(OC6H4CH=NCH2COO)SbPh3]·CH2Cl2 or [Sb(C6H5)3(C9H7NO3)]·CH2Cl2, is a mononuclear antimony(V) complex. The asymmetric unit comprises two independent mol­ecules of the complex and two solvent molecules. In both complex molecules, the Sb atoms are in distorted octahedral environments.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805006446/ci6523sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805006446/ci6523Isup2.hkl
Contains datablock I

CCDC reference: 240983

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.010 Å
  • Disorder in solvent or counterion
  • R factor = 0.042
  • wR factor = 0.097
  • Data-to-parameter ratio = 13.2

checkCIF/PLATON results

No syntax errors found



Alert level C PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 2.86 Ratio PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.02 Ratio PLAT221_ALERT_4_C Large Solvent/Anion C Ueq(max)/Ueq(min) ... 3.79 Ratio PLAT223_ALERT_4_C Large Solvent/Anion H Ueq(max)/Ueq(min) ... 3.74 Ratio PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C40 PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors for C56 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C56' PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C56" PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C55' PLAT302_ALERT_4_C Anion/Solvent Disorder ......................... 40.00 Perc. PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 10 PLAT431_ALERT_2_C Short Inter HL..A Contact Cl4 .. Cl4 .. 3.25 Ang.
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 12 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 4 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 7 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 1998); cell refinement: SAINT (Bruker, 1998); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 1997); software used to prepare material for publication: SHELXTL.

Triphenyl[(2-oxidobenzylideneamino)acetato]antimony(V) dichloromethane solvate top
Crystal data top
[Sb(C6H5)3(C9H7NO3)]F(000) = 2464
Mr = 615.14Dx = 1.518 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybcCell parameters from 1019 reflections
a = 21.071 (6) Åθ = 2.8–24.2°
b = 10.944 (3) ŵ = 1.25 mm1
c = 25.569 (8) ÅT = 293 K
β = 114.109 (5)°Block, colourless
V = 5382 (3) Å30.22 × 0.20 × 0.16 mm
Z = 8
Data collection top
Bruker SMART CCD area-detector
diffractometer
9460 independent reflections
Radiation source: fine-focus sealed tube6705 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.041
φ and ω scansθmax = 25.0°, θmin = 1.1°
Absorption correction: multi-scan
(SADABS; Sheldrick, 1996)
h = 2522
Tmin = 0.726, Tmax = 0.818k = 1312
27059 measured reflectionsl = 2330
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.042Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.097H-atom parameters constrained
S = 1.08 w = 1/[σ2(Fo2) + (0.0341P)2 + 5.6596P]
where P = (Fo2 + 2Fc2)/3
9460 reflections(Δ/σ)max = 0.005
716 parametersΔρmax = 0.65 e Å3
106 restraintsΔρmin = 0.53 e Å3
Special details top

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) top
xyzUiso*/UeqOcc. (<1)
Sb10.401069 (17)0.43086 (3)0.160734 (13)0.03832 (10)
Sb20.097829 (17)0.83142 (3)0.846904 (13)0.03971 (10)
O10.49944 (16)0.5007 (3)0.19483 (13)0.0453 (8)
O20.32116 (17)0.3024 (3)0.13511 (14)0.0499 (9)
O30.2903 (2)0.1097 (4)0.1323 (2)0.0924 (15)
O40.00341 (17)0.7791 (3)0.80617 (13)0.0459 (8)
O50.18453 (18)0.9461 (3)0.87989 (15)0.0531 (9)
O60.2290 (2)1.1258 (4)0.8746 (2)0.0857 (14)
N10.4567 (2)0.2497 (4)0.17339 (15)0.0420 (10)
N20.0535 (2)1.0216 (4)0.83175 (16)0.0422 (10)
C10.5540 (3)0.4579 (5)0.18561 (19)0.0442 (13)
C20.6063 (3)0.5429 (6)0.1903 (2)0.0550 (14)
H20.60050.62450.19760.066*
C30.6652 (3)0.5078 (7)0.1844 (3)0.0700 (18)
H30.69910.56560.18810.084*
C40.6750 (3)0.3884 (7)0.1731 (3)0.077 (2)
H40.71500.36540.16870.092*
C50.6253 (3)0.3038 (6)0.1684 (3)0.0682 (17)
H50.63240.22290.16100.082*
C60.5634 (3)0.3349 (5)0.1743 (2)0.0497 (13)
C70.5158 (3)0.2368 (5)0.1712 (2)0.0508 (14)
H70.52950.15780.16730.061*
C80.4106 (3)0.1485 (5)0.1695 (2)0.0561 (15)
H8A0.42250.11500.20750.067*
H8B0.41730.08470.14590.067*
C90.3351 (3)0.1869 (5)0.1442 (2)0.0531 (14)
C100.4096 (3)0.4076 (4)0.2469 (2)0.0429 (12)
C110.3516 (3)0.4222 (5)0.2587 (3)0.0673 (17)
H110.30900.44210.22940.081*
C120.3567 (5)0.4071 (6)0.3144 (4)0.092 (2)
H120.31760.41690.32210.111*
C130.4193 (6)0.3778 (7)0.3579 (3)0.099 (3)
H130.42240.36760.39490.119*
C140.4771 (4)0.3634 (6)0.3471 (3)0.081 (2)
H140.51950.34410.37680.097*
C150.4727 (3)0.3776 (5)0.2919 (2)0.0564 (15)
H150.51220.36720.28470.068*
C160.3396 (2)0.5933 (4)0.1446 (2)0.0408 (12)
C170.2796 (3)0.6040 (5)0.0950 (2)0.0562 (15)
H170.26530.53960.06900.067*
C180.2408 (3)0.7100 (6)0.0838 (2)0.0649 (16)
H180.20000.71580.05060.078*
C190.2617 (3)0.8067 (5)0.1208 (2)0.0606 (15)
H190.23560.87820.11280.073*
C200.3214 (3)0.7974 (5)0.1700 (3)0.0648 (17)
H200.33620.86310.19520.078*
C210.3594 (3)0.6909 (5)0.1821 (2)0.0550 (14)
H210.39910.68450.21610.066*
C220.4016 (3)0.4263 (5)0.0770 (2)0.0470 (13)
C230.4205 (3)0.5313 (6)0.0571 (3)0.0700 (18)
H230.43210.60150.07960.084*
C240.4221 (4)0.5317 (9)0.0030 (3)0.104 (3)
H240.43490.60240.01050.125*
C250.4048 (4)0.4273 (12)0.0306 (3)0.116 (4)
H250.40710.42730.06610.139*
C260.3846 (4)0.3252 (9)0.0116 (3)0.102 (3)
H260.37160.25600.03470.122*
C270.3831 (3)0.3236 (6)0.0419 (2)0.0681 (17)
H270.36960.25270.05470.082*
C280.0572 (3)0.8331 (5)0.81284 (19)0.0421 (12)
C290.1129 (3)0.7604 (6)0.8082 (2)0.0564 (15)
H290.11050.67650.80360.068*
C300.1720 (3)0.8104 (7)0.8104 (2)0.0706 (18)
H300.20900.75980.80670.085*
C310.1767 (3)0.9341 (7)0.8179 (3)0.0748 (19)
H310.21670.96710.81930.090*
C320.1223 (3)1.0075 (6)0.8232 (2)0.0594 (15)
H320.12571.09110.82810.071*
C330.0612 (3)0.9611 (5)0.8214 (2)0.0461 (13)
C340.0076 (3)1.0480 (4)0.82639 (19)0.0454 (13)
H340.01861.13050.82560.054*
C350.1061 (3)1.1117 (5)0.8359 (2)0.0553 (14)
H35A0.10141.18200.85720.066*
H35B0.09851.13900.79770.066*
C360.1794 (3)1.0607 (5)0.8653 (2)0.0568 (15)
C370.0995 (3)0.8549 (4)0.7638 (2)0.0507 (14)
C380.0400 (4)0.8864 (5)0.7159 (2)0.0656 (17)
H380.00200.89680.71920.079*
C390.0431 (5)0.9023 (6)0.6631 (3)0.098 (3)
H390.00350.92370.63100.118*
C400.1058 (7)0.8860 (8)0.6590 (4)0.120 (4)
H400.10780.89490.62350.144*
C410.1652 (5)0.8567 (7)0.7060 (4)0.103 (3)
H410.20740.84820.70270.124*
C420.1613 (4)0.8402 (5)0.7580 (3)0.0706 (18)
H420.20110.81860.78980.085*
C430.0850 (3)0.8403 (4)0.9265 (2)0.0430 (12)
C440.1071 (3)0.9374 (5)0.9638 (2)0.0652 (17)
H440.13031.00250.95600.078*
C450.0946 (4)0.9380 (6)1.0136 (3)0.083 (2)
H450.10911.00421.03850.099*
C460.0616 (4)0.8433 (8)1.0259 (3)0.082 (2)
H460.05370.84421.05900.099*
C470.0404 (3)0.7470 (7)0.9893 (3)0.078 (2)
H470.01740.68220.99760.094*
C480.0522 (3)0.7437 (6)0.9398 (2)0.0593 (15)
H480.03810.67640.91550.071*
C490.1494 (2)0.6583 (4)0.86485 (19)0.0397 (11)
C500.1983 (3)0.6321 (5)0.9193 (2)0.0555 (15)
H500.20930.69040.94810.067*
C510.2308 (3)0.5196 (5)0.9311 (2)0.0631 (16)
H510.26450.50300.96760.076*
C520.2133 (3)0.4320 (5)0.8887 (2)0.0559 (15)
H520.23430.35550.89680.067*
C530.1652 (3)0.4576 (5)0.8348 (2)0.0534 (14)
H530.15330.39870.80620.064*
C540.1344 (3)0.5714 (5)0.8231 (2)0.0487 (13)
H540.10270.58930.78610.058*
C550.1516 (13)0.3056 (14)0.0398 (6)0.121 (9)0.557 (7)
H55A0.19020.31440.07690.146*0.557 (7)
H55B0.11880.24850.04400.146*0.557 (7)
Cl10.1821 (4)0.2463 (4)0.0079 (2)0.133 (2)0.557 (7)
Cl20.1115 (2)0.4453 (4)0.0187 (3)0.131 (2)0.557 (7)
C55'0.1494 (18)0.2770 (16)0.0409 (4)0.126 (12)0.443 (7)
H55C0.13000.20920.05400.152*0.443 (7)
H55D0.19940.26560.05600.152*0.443 (7)
Cl1'0.1156 (6)0.2765 (8)0.0328 (3)0.166 (4)0.443 (7)
Cl2'0.1315 (4)0.4116 (6)0.0671 (4)0.133 (3)0.443 (7)
C560.3513 (15)0.622 (2)0.4893 (19)0.25 (2)0.414 (4)
H56A0.36130.70020.50840.299*0.414 (4)
H56B0.31570.63380.45090.299*0.414 (4)
Cl30.3199 (4)0.5244 (7)0.5260 (3)0.114 (2)0.414 (4)
Cl40.4256 (4)0.5664 (11)0.4847 (4)0.161 (4)0.414 (4)
C56'0.3422 (9)0.565 (2)0.4674 (8)0.067 (7)0.330 (6)
H56C0.30270.58690.43260.080*0.330 (6)
H56D0.34870.47720.46700.080*0.330 (6)
Cl3'0.3251 (5)0.6030 (10)0.5257 (4)0.110 (3)0.330 (6)
Cl4'0.4153 (8)0.6380 (13)0.4691 (7)0.201 (7)0.330 (6)
C56"0.3464 (7)0.539 (2)0.4841 (15)0.097 (15)0.256 (4)
H56E0.33270.56000.51480.117*0.256 (4)
H56F0.31180.48430.45800.117*0.256 (4)
Cl3"0.4261 (4)0.4676 (7)0.5119 (4)0.101 (3)0.256 (4)
Cl4"0.3500 (6)0.6704 (9)0.4479 (5)0.156 (5)0.256 (4)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Sb10.0377 (2)0.0385 (2)0.03867 (19)0.00309 (16)0.01550 (15)0.00003 (15)
Sb20.0435 (2)0.03455 (19)0.04037 (19)0.00382 (16)0.01647 (16)0.00048 (15)
O10.040 (2)0.046 (2)0.051 (2)0.0021 (17)0.0198 (17)0.0050 (16)
O20.045 (2)0.045 (2)0.057 (2)0.0038 (18)0.0182 (18)0.0056 (17)
O30.079 (3)0.058 (3)0.160 (5)0.019 (3)0.069 (3)0.012 (3)
O40.044 (2)0.042 (2)0.048 (2)0.0026 (17)0.0144 (17)0.0047 (16)
O50.052 (2)0.045 (2)0.059 (2)0.0033 (18)0.0192 (18)0.0041 (18)
O60.075 (3)0.054 (3)0.137 (4)0.023 (2)0.053 (3)0.008 (3)
N10.047 (3)0.043 (3)0.035 (2)0.003 (2)0.016 (2)0.0013 (18)
N20.047 (3)0.036 (2)0.042 (2)0.002 (2)0.016 (2)0.0010 (18)
C10.038 (3)0.062 (4)0.029 (3)0.006 (3)0.010 (2)0.006 (2)
C20.046 (3)0.071 (4)0.048 (3)0.002 (3)0.019 (3)0.011 (3)
C30.050 (4)0.092 (5)0.070 (4)0.003 (4)0.026 (3)0.020 (4)
C40.044 (4)0.109 (6)0.089 (5)0.014 (4)0.038 (4)0.023 (4)
C50.063 (4)0.075 (4)0.073 (4)0.029 (4)0.035 (3)0.016 (3)
C60.043 (3)0.064 (4)0.042 (3)0.012 (3)0.017 (2)0.008 (3)
C70.059 (4)0.052 (3)0.042 (3)0.020 (3)0.022 (3)0.004 (2)
C80.076 (4)0.040 (3)0.058 (3)0.005 (3)0.033 (3)0.007 (3)
C90.057 (4)0.048 (4)0.063 (4)0.004 (3)0.035 (3)0.004 (3)
C100.054 (3)0.040 (3)0.038 (3)0.005 (3)0.022 (3)0.001 (2)
C110.080 (4)0.066 (4)0.075 (4)0.002 (3)0.051 (4)0.003 (3)
C120.141 (7)0.080 (5)0.097 (6)0.004 (5)0.090 (6)0.005 (4)
C130.181 (9)0.081 (5)0.057 (5)0.017 (6)0.071 (6)0.005 (4)
C140.126 (6)0.068 (4)0.039 (4)0.009 (4)0.024 (4)0.001 (3)
C150.071 (4)0.049 (3)0.048 (3)0.000 (3)0.022 (3)0.000 (3)
C160.035 (3)0.043 (3)0.043 (3)0.007 (2)0.015 (2)0.002 (2)
C170.056 (4)0.051 (3)0.051 (3)0.010 (3)0.012 (3)0.012 (3)
C180.053 (4)0.074 (4)0.050 (3)0.015 (3)0.003 (3)0.004 (3)
C190.063 (4)0.048 (4)0.068 (4)0.018 (3)0.024 (3)0.003 (3)
C200.067 (4)0.044 (3)0.068 (4)0.004 (3)0.012 (3)0.013 (3)
C210.058 (4)0.042 (3)0.048 (3)0.007 (3)0.004 (3)0.008 (3)
C220.045 (3)0.062 (4)0.037 (3)0.017 (3)0.019 (2)0.009 (3)
C230.058 (4)0.093 (5)0.062 (4)0.009 (4)0.027 (3)0.021 (4)
C240.071 (5)0.164 (9)0.085 (6)0.020 (6)0.040 (5)0.061 (6)
C250.083 (6)0.220 (12)0.051 (5)0.049 (7)0.035 (4)0.036 (6)
C260.098 (6)0.165 (8)0.038 (4)0.044 (6)0.023 (4)0.006 (5)
C270.070 (4)0.085 (5)0.046 (3)0.022 (4)0.020 (3)0.000 (3)
C280.041 (3)0.052 (3)0.030 (2)0.006 (3)0.011 (2)0.003 (2)
C290.057 (4)0.063 (4)0.049 (3)0.002 (3)0.022 (3)0.007 (3)
C300.053 (4)0.099 (6)0.064 (4)0.004 (4)0.028 (3)0.004 (4)
C310.060 (4)0.095 (6)0.079 (5)0.010 (4)0.038 (4)0.003 (4)
C320.064 (4)0.064 (4)0.051 (3)0.017 (3)0.024 (3)0.001 (3)
C330.053 (3)0.049 (3)0.036 (3)0.010 (3)0.018 (2)0.006 (2)
C340.068 (4)0.029 (3)0.037 (3)0.016 (3)0.019 (3)0.005 (2)
C350.075 (4)0.036 (3)0.057 (3)0.002 (3)0.029 (3)0.003 (3)
C360.068 (4)0.045 (4)0.063 (4)0.008 (3)0.032 (3)0.010 (3)
C370.076 (4)0.035 (3)0.051 (3)0.007 (3)0.036 (3)0.000 (2)
C380.099 (5)0.044 (3)0.052 (4)0.001 (3)0.029 (4)0.003 (3)
C390.164 (9)0.067 (5)0.053 (4)0.002 (5)0.034 (5)0.007 (3)
C400.244 (14)0.071 (5)0.075 (6)0.031 (7)0.096 (8)0.005 (4)
C410.166 (9)0.077 (5)0.123 (7)0.008 (6)0.116 (7)0.009 (5)
C420.100 (5)0.051 (4)0.090 (5)0.005 (4)0.069 (4)0.000 (3)
C430.046 (3)0.039 (3)0.042 (3)0.011 (2)0.016 (2)0.003 (2)
C440.094 (5)0.049 (4)0.051 (3)0.012 (3)0.028 (3)0.002 (3)
C450.132 (7)0.066 (5)0.054 (4)0.027 (5)0.041 (4)0.004 (3)
C460.090 (5)0.111 (6)0.054 (4)0.037 (5)0.037 (4)0.015 (4)
C470.063 (4)0.113 (6)0.064 (4)0.001 (4)0.031 (4)0.022 (4)
C480.060 (4)0.067 (4)0.050 (3)0.003 (3)0.022 (3)0.005 (3)
C490.046 (3)0.037 (3)0.037 (3)0.005 (2)0.018 (2)0.001 (2)
C500.069 (4)0.050 (3)0.044 (3)0.009 (3)0.019 (3)0.009 (3)
C510.068 (4)0.065 (4)0.046 (3)0.019 (3)0.013 (3)0.007 (3)
C520.063 (4)0.036 (3)0.073 (4)0.009 (3)0.032 (3)0.009 (3)
C530.063 (4)0.038 (3)0.051 (3)0.001 (3)0.015 (3)0.011 (3)
C540.046 (3)0.049 (3)0.041 (3)0.001 (3)0.008 (2)0.007 (3)
C550.117 (12)0.104 (11)0.126 (12)0.000 (8)0.032 (8)0.018 (8)
Cl10.175 (6)0.120 (4)0.115 (4)0.044 (3)0.069 (4)0.024 (3)
Cl20.105 (3)0.114 (3)0.161 (5)0.016 (3)0.040 (3)0.002 (3)
C55'0.126 (15)0.118 (14)0.124 (15)0.002 (9)0.040 (9)0.005 (9)
Cl1'0.198 (8)0.190 (6)0.141 (5)0.023 (6)0.100 (5)0.024 (4)
Cl2'0.147 (5)0.101 (4)0.158 (6)0.021 (4)0.069 (5)0.039 (4)
C560.23 (2)0.27 (2)0.25 (2)0.001 (10)0.097 (13)0.001 (10)
Cl30.135 (5)0.127 (5)0.088 (4)0.033 (5)0.053 (3)0.018 (4)
Cl40.101 (4)0.216 (8)0.154 (6)0.039 (5)0.040 (4)0.053 (6)
C56'0.053 (10)0.080 (10)0.060 (9)0.011 (8)0.017 (7)0.003 (8)
Cl3'0.104 (5)0.143 (7)0.086 (5)0.029 (5)0.043 (4)0.010 (5)
Cl4'0.226 (11)0.181 (9)0.196 (9)0.035 (8)0.088 (8)0.025 (7)
C56"0.084 (17)0.092 (18)0.108 (18)0.018 (9)0.030 (11)0.001 (10)
Cl3"0.101 (6)0.079 (5)0.101 (6)0.014 (4)0.017 (4)0.002 (4)
Cl4"0.109 (7)0.131 (7)0.187 (9)0.010 (6)0.021 (6)0.062 (6)
Geometric parameters (Å, º) top
Sb1—O12.041 (3)C27—H270.93
Sb1—O22.083 (3)C28—C291.382 (7)
Sb1—C162.138 (5)C28—C331.426 (7)
Sb1—C222.147 (5)C29—C301.382 (8)
Sb1—C102.151 (5)C29—H290.93
Sb1—N12.259 (4)C30—C311.377 (9)
Sb2—O42.037 (3)C30—H300.93
Sb2—O52.089 (4)C31—C321.362 (8)
Sb2—C492.139 (5)C31—H310.93
Sb2—C372.156 (5)C32—C331.400 (7)
Sb2—C432.162 (5)C32—H320.93
Sb2—N22.249 (4)C33—C341.444 (7)
O1—C11.349 (5)C34—H340.93
O2—C91.298 (6)C35—C361.521 (8)
O3—C91.210 (6)C35—H35A0.97
O4—C281.350 (5)C35—H35B0.97
O5—C361.300 (6)C37—C421.379 (7)
O6—C361.207 (6)C37—C381.391 (8)
N1—C71.277 (6)C38—C391.388 (9)
N1—C81.449 (6)C38—H380.93
N2—C341.270 (6)C39—C401.378 (12)
N2—C351.455 (6)C39—H390.93
C1—C61.408 (7)C40—C411.373 (12)
C1—C21.408 (7)C40—H400.93
C2—C31.366 (7)C41—C421.378 (9)
C2—H20.93C41—H410.93
C3—C41.372 (9)C42—H420.93
C3—H30.93C43—C441.376 (7)
C4—C51.366 (8)C43—C481.378 (7)
C4—H40.93C44—C451.402 (8)
C5—C61.415 (7)C44—H440.93
C5—H50.93C45—C461.354 (9)
C6—C71.449 (7)C45—H450.93
C7—H70.93C46—C471.356 (9)
C8—C91.512 (7)C46—H460.93
C8—H8A0.97C47—C481.390 (7)
C8—H8B0.97C47—H470.93
C10—C111.382 (7)C48—H480.93
C10—C151.397 (7)C49—C541.367 (6)
C11—C121.394 (8)C49—C501.381 (7)
C11—H110.93C50—C511.381 (7)
C12—C131.371 (10)C50—H500.93
C12—H120.93C51—C521.380 (7)
C13—C141.364 (10)C51—H510.93
C13—H130.93C52—C531.365 (7)
C14—C151.385 (7)C52—H520.93
C14—H140.93C53—C541.380 (7)
C15—H150.93C53—H530.93
C16—C211.381 (7)C54—H540.93
C16—C171.384 (7)C55—Cl11.720 (5)
C17—C181.379 (7)C55—Cl21.724 (5)
C17—H170.93C55—H55A0.97
C18—C191.368 (7)C55—H55B0.97
C18—H180.93C55'—Cl2'1.722 (5)
C19—C201.372 (7)C55'—Cl1'1.722 (5)
C19—H190.93C55'—H55C0.97
C20—C211.375 (7)C55'—H55D0.97
C20—H200.93C56—Cl31.719 (5)
C21—H210.93C56—Cl41.726 (5)
C22—C231.380 (8)C56—H56A0.97
C22—C271.391 (7)C56—H56B0.97
C23—C241.397 (9)C56'—Cl3'1.720 (5)
C23—H230.93C56'—Cl4'1.722 (5)
C24—C251.385 (12)C56'—H56C0.97
C24—H240.93C56'—H56D0.97
C25—C261.354 (12)C56"—Cl3"1.722 (5)
C25—H250.93C56"—Cl4"1.724 (5)
C26—C271.381 (8)C56"—H56E0.97
C26—H260.93C56"—H56F0.97
O1—Sb1—O2159.49 (14)C25—C26—H26119.9
O1—Sb1—C16101.55 (16)C27—C26—H26119.9
O2—Sb1—C1698.78 (16)C26—C27—C22121.0 (7)
O1—Sb1—C2290.96 (17)C26—C27—H27119.5
O2—Sb1—C2290.19 (18)C22—C27—H27119.5
C16—Sb1—C2294.37 (18)O4—C28—C29117.7 (5)
O1—Sb1—C1087.81 (16)O4—C28—C33123.7 (5)
O2—Sb1—C1087.73 (16)C29—C28—C33118.5 (5)
C16—Sb1—C1094.99 (18)C30—C29—C28121.1 (6)
C22—Sb1—C10170.62 (19)C30—C29—H29119.5
O1—Sb1—N183.71 (14)C28—C29—H29119.5
O2—Sb1—N176.01 (14)C31—C30—C29120.9 (6)
C16—Sb1—N1174.70 (17)C31—C30—H30119.6
C22—Sb1—N184.75 (16)C29—C30—H30119.6
C10—Sb1—N185.87 (16)C32—C31—C30119.2 (6)
O4—Sb2—O5159.35 (14)C32—C31—H31120.4
O4—Sb2—C49101.26 (16)C30—C31—H31120.4
O5—Sb2—C4999.29 (17)C31—C32—C33122.0 (6)
O4—Sb2—C3787.97 (18)C31—C32—H32119.0
O5—Sb2—C3787.87 (18)C33—C32—H32119.0
C49—Sb2—C3796.07 (18)C32—C33—C28118.4 (5)
O4—Sb2—C4389.22 (16)C32—C33—C34117.0 (5)
O5—Sb2—C4391.03 (17)C28—C33—C34124.6 (5)
C49—Sb2—C4394.93 (17)N2—C34—C33125.6 (5)
C37—Sb2—C43168.98 (18)N2—C34—H34117.2
O4—Sb2—N284.11 (14)C33—C34—H34117.2
O5—Sb2—N275.34 (14)N2—C35—C36112.1 (4)
C49—Sb2—N2174.63 (17)N2—C35—H35A109.2
C37—Sb2—N283.83 (16)C36—C35—H35A109.2
C43—Sb2—N285.28 (16)N2—C35—H35B109.2
C1—O1—Sb1125.8 (3)C36—C35—H35B109.2
C9—O2—Sb1120.4 (3)H35A—C35—H35B107.9
C28—O4—Sb2124.8 (3)O6—C36—O5123.3 (6)
C36—O5—Sb2120.5 (4)O6—C36—C35120.2 (5)
C7—N1—C8123.4 (5)O5—C36—C35116.4 (5)
C7—N1—Sb1123.3 (4)C42—C37—C38119.0 (5)
C8—N1—Sb1111.5 (3)C42—C37—Sb2119.2 (4)
C34—N2—C35124.2 (4)C38—C37—Sb2121.8 (4)
C34—N2—Sb2124.1 (3)C39—C38—C37120.2 (7)
C35—N2—Sb2111.3 (3)C39—C38—H38119.9
O1—C1—C6124.7 (5)C37—C38—H38119.9
O1—C1—C2116.6 (5)C40—C39—C38119.1 (8)
C6—C1—C2118.6 (5)C40—C39—H39120.5
C3—C2—C1121.2 (6)C38—C39—H39120.5
C3—C2—H2119.4C41—C40—C39121.5 (7)
C1—C2—H2119.4C41—C40—H40119.3
C2—C3—C4120.9 (6)C39—C40—H40119.3
C2—C3—H3119.5C40—C41—C42118.8 (8)
C4—C3—H3119.5C40—C41—H41120.6
C5—C4—C3119.2 (6)C42—C41—H41120.6
C5—C4—H4120.4C41—C42—C37121.3 (7)
C3—C4—H4120.4C41—C42—H42119.3
C4—C5—C6122.3 (6)C37—C42—H42119.3
C4—C5—H5118.9C44—C43—C48119.0 (5)
C6—C5—H5118.9C44—C43—Sb2123.3 (4)
C1—C6—C5117.7 (5)C48—C43—Sb2117.7 (4)
C1—C6—C7124.6 (5)C43—C44—C45119.8 (6)
C5—C6—C7117.6 (5)C43—C44—H44120.1
N1—C7—C6125.6 (5)C45—C44—H44120.1
N1—C7—H7117.2C46—C45—C44120.8 (6)
C6—C7—H7117.2C46—C45—H45119.6
N1—C8—C9112.1 (4)C44—C45—H45119.6
N1—C8—H8A109.2C45—C46—C47119.4 (6)
C9—C8—H8A109.2C45—C46—H46120.3
N1—C8—H8B109.2C47—C46—H46120.3
C9—C8—H8B109.2C46—C47—C48121.1 (7)
H8A—C8—H8B107.9C46—C47—H47119.5
O3—C9—O2122.6 (6)C48—C47—H47119.5
O3—C9—C8119.4 (5)C43—C48—C47120.0 (6)
O2—C9—C8118.0 (5)C43—C48—H48120.0
C11—C10—C15118.5 (5)C47—C48—H48120.0
C11—C10—Sb1119.9 (4)C54—C49—C50118.8 (5)
C15—C10—Sb1121.6 (4)C54—C49—Sb2120.9 (4)
C10—C11—C12120.2 (6)C50—C49—Sb2120.3 (4)
C10—C11—H11119.9C51—C50—C49120.4 (5)
C12—C11—H11119.9C51—C50—H50119.8
C13—C12—C11120.2 (7)C49—C50—H50119.8
C13—C12—H12119.9C52—C51—C50119.8 (5)
C11—C12—H12119.9C52—C51—H51120.1
C14—C13—C12120.4 (6)C50—C51—H51120.1
C14—C13—H13119.8C53—C52—C51120.1 (5)
C12—C13—H13119.8C53—C52—H52120.0
C13—C14—C15120.0 (7)C51—C52—H52120.0
C13—C14—H14120.0C52—C53—C54119.6 (5)
C15—C14—H14120.0C52—C53—H53120.2
C14—C15—C10120.6 (6)C54—C53—H53120.2
C14—C15—H15119.7C49—C54—C53121.4 (5)
C10—C15—H15119.7C49—C54—H54119.3
C21—C16—C17118.3 (5)C53—C54—H54119.3
C21—C16—Sb1121.5 (4)Cl1—C55—Cl2113.0 (5)
C17—C16—Sb1120.2 (4)Cl1—C55—H55A109.0
C18—C17—C16120.3 (5)Cl2—C55—H55A109.0
C18—C17—H17119.9Cl1—C55—H55B109.0
C16—C17—H17119.9Cl2—C55—H55B109.0
C19—C18—C17120.7 (5)H55A—C55—H55B107.8
C19—C18—H18119.6Cl2'—C55'—Cl1'111.7 (6)
C17—C18—H18119.6Cl2'—C55'—H55C109.3
C18—C19—C20119.6 (5)Cl1'—C55'—H55C109.3
C18—C19—H19120.2Cl2'—C55'—H55D109.3
C20—C19—H19120.2Cl1'—C55'—H55D109.3
C19—C20—C21120.0 (5)H55C—C55'—H55D107.9
C19—C20—H20120.0Cl3—C56—Cl4112.5 (6)
C21—C20—H20120.0Cl3—C56—H56A109.1
C20—C21—C16121.1 (5)Cl4—C56—H56A109.1
C20—C21—H21119.4Cl3—C56—H56B109.1
C16—C21—H21119.4Cl4—C56—H56B109.1
C23—C22—C27118.8 (5)H56A—C56—H56B107.8
C23—C22—Sb1117.9 (4)Cl3'—C56'—Cl4'111.6 (6)
C27—C22—Sb1123.3 (4)Cl3'—C56'—H56C109.3
C22—C23—C24119.7 (7)Cl4'—C56'—H56C109.3
C22—C23—H23120.2Cl3'—C56'—H56D109.3
C24—C23—H23120.2Cl4'—C56'—H56D109.3
C25—C24—C23120.2 (8)H56C—C56'—H56D108.0
C25—C24—H24119.9Cl3"—C56"—Cl4"110.7 (6)
C23—C24—H24119.9Cl3"—C56"—H56E109.5
C26—C25—C24120.1 (7)Cl4"—C56"—H56E109.5
C26—C25—H25120.0Cl3"—C56"—H56F109.5
C24—C25—H25120.0Cl4"—C56"—H56F109.5
C25—C26—C27120.2 (8)H56E—C56"—H56F108.1
O2—Sb1—O1—C145.3 (6)O1—Sb1—C22—C2350.8 (4)
C16—Sb1—O1—C1142.5 (4)O2—Sb1—C22—C23149.7 (4)
C22—Sb1—O1—C147.8 (4)C16—Sb1—C22—C2350.8 (4)
C10—Sb1—O1—C1122.9 (4)N1—Sb1—C22—C23134.4 (4)
N1—Sb1—O1—C136.8 (4)O1—Sb1—C22—C27129.9 (4)
O1—Sb1—O2—C90.8 (6)O2—Sb1—C22—C2729.6 (5)
C16—Sb1—O2—C9171.5 (4)C16—Sb1—C22—C27128.4 (5)
C22—Sb1—O2—C994.1 (4)N1—Sb1—C22—C2746.3 (4)
C10—Sb1—O2—C976.8 (4)C27—C22—C23—C241.3 (8)
N1—Sb1—O2—C99.5 (4)Sb1—C22—C23—C24179.4 (5)
O5—Sb2—O4—C2844.4 (6)C22—C23—C24—C250.0 (10)
C49—Sb2—O4—C28141.3 (4)C23—C24—C25—C261.6 (12)
C37—Sb2—O4—C28122.9 (4)C24—C25—C26—C272.0 (12)
C43—Sb2—O4—C2846.5 (4)C25—C26—C27—C220.7 (10)
N2—Sb2—O4—C2838.9 (3)C23—C22—C27—C261.0 (9)
O4—Sb2—O5—C3612.1 (6)Sb1—C22—C27—C26179.8 (5)
C49—Sb2—O5—C36162.2 (4)Sb2—O4—C28—C29147.8 (3)
C37—Sb2—O5—C3666.4 (4)Sb2—O4—C28—C3335.4 (6)
C43—Sb2—O5—C36102.7 (4)O4—C28—C29—C30175.3 (5)
N2—Sb2—O5—C3617.8 (4)C33—C28—C29—C301.6 (7)
O1—Sb1—N1—C730.2 (4)C28—C29—C30—C310.8 (9)
O2—Sb1—N1—C7152.9 (4)C29—C30—C31—C320.0 (9)
C22—Sb1—N1—C761.4 (4)C30—C31—C32—C330.2 (9)
C10—Sb1—N1—C7118.4 (4)C31—C32—C33—C281.1 (8)
O1—Sb1—N1—C8164.5 (3)C31—C32—C33—C34178.8 (5)
O2—Sb1—N1—C812.5 (3)O4—C28—C33—C32174.9 (4)
C22—Sb1—N1—C8104.0 (3)C29—C28—C33—C321.8 (7)
C10—Sb1—N1—C876.2 (3)O4—C28—C33—C342.6 (7)
O4—Sb2—N2—C3426.6 (4)C29—C28—C33—C34179.3 (4)
O5—Sb2—N2—C34155.4 (4)C35—N2—C34—C33179.2 (4)
C37—Sb2—N2—C34115.2 (4)Sb2—N2—C34—C338.7 (7)
C43—Sb2—N2—C3463.1 (4)C32—C33—C34—N2172.1 (5)
O4—Sb2—N2—C35160.4 (3)C28—C33—C34—N210.3 (8)
O5—Sb2—N2—C3517.6 (3)C34—N2—C35—C36156.7 (5)
C37—Sb2—N2—C3571.8 (3)Sb2—N2—C35—C3616.3 (5)
C43—Sb2—N2—C35109.9 (3)Sb2—O5—C36—O6166.5 (4)
Sb1—O1—C1—C630.2 (6)Sb2—O5—C36—C3514.1 (6)
Sb1—O1—C1—C2152.6 (3)N2—C35—C36—O6176.4 (5)
O1—C1—C2—C3177.0 (5)N2—C35—C36—O52.9 (7)
C6—C1—C2—C30.3 (7)O4—Sb2—C37—C42151.6 (4)
C1—C2—C3—C40.6 (9)O5—Sb2—C37—C4248.6 (4)
C2—C3—C4—C50.7 (9)C49—Sb2—C37—C4250.5 (4)
C3—C4—C5—C60.5 (9)C43—Sb2—C37—C42133.1 (10)
O1—C1—C6—C5176.9 (4)N2—Sb2—C37—C42124.1 (4)
C2—C1—C6—C50.1 (7)O4—Sb2—C37—C3829.4 (4)
O1—C1—C6—C70.3 (8)O5—Sb2—C37—C38130.4 (4)
C2—C1—C6—C7176.7 (4)C49—Sb2—C37—C38130.5 (4)
C4—C5—C6—C10.2 (8)C43—Sb2—C37—C3846.0 (13)
C4—C5—C6—C7177.1 (5)N2—Sb2—C37—C3854.9 (4)
C8—N1—C7—C6179.3 (4)C42—C37—C38—C390.1 (8)
Sb1—N1—C7—C615.7 (7)Sb2—C37—C38—C39179.2 (5)
C1—C6—C7—N16.4 (8)C37—C38—C39—C400.3 (10)
C5—C6—C7—N1177.0 (5)C38—C39—C40—C411.3 (13)
C7—N1—C8—C9151.5 (5)C39—C40—C41—C421.8 (13)
Sb1—N1—C8—C913.8 (5)C40—C41—C42—C371.4 (11)
Sb1—O2—C9—O3176.7 (4)C38—C37—C42—C410.4 (9)
Sb1—O2—C9—C84.7 (6)Sb2—C37—C42—C41178.6 (5)
N1—C8—C9—O3171.7 (5)O4—Sb2—C43—C44132.7 (5)
N1—C8—C9—O27.0 (7)O5—Sb2—C43—C4426.6 (5)
O1—Sb1—C10—C11145.8 (4)C49—Sb2—C43—C44126.1 (5)
O2—Sb1—C10—C1154.2 (4)C37—Sb2—C43—C4457.5 (13)
C16—Sb1—C10—C1144.4 (4)N2—Sb2—C43—C4448.6 (5)
N1—Sb1—C10—C11130.3 (4)O4—Sb2—C43—C4846.6 (4)
O1—Sb1—C10—C1534.2 (4)O5—Sb2—C43—C48154.1 (4)
O2—Sb1—C10—C15125.8 (4)C49—Sb2—C43—C4854.7 (4)
C16—Sb1—C10—C15135.6 (4)C37—Sb2—C43—C48121.8 (10)
N1—Sb1—C10—C1549.6 (4)N2—Sb2—C43—C48130.7 (4)
C15—C10—C11—C120.0 (8)C48—C43—C44—C451.5 (8)
Sb1—C10—C11—C12179.9 (5)Sb2—C43—C44—C45177.7 (4)
C10—C11—C12—C130.1 (10)C43—C44—C45—C460.8 (10)
C11—C12—C13—C140.2 (12)C44—C45—C46—C470.2 (11)
C12—C13—C14—C150.4 (11)C45—C46—C47—C480.4 (10)
C13—C14—C15—C100.5 (9)C44—C43—C48—C471.7 (8)
C11—C10—C15—C140.2 (8)Sb2—C43—C48—C47177.6 (4)
Sb1—C10—C15—C14179.8 (4)C46—C47—C48—C431.2 (9)
O1—Sb1—C16—C2138.2 (4)O4—Sb2—C49—C5448.7 (4)
O2—Sb1—C16—C21139.0 (4)O5—Sb2—C49—C54129.3 (4)
C22—Sb1—C16—C21130.1 (4)C37—Sb2—C49—C5440.5 (4)
C10—Sb1—C16—C2150.5 (4)C43—Sb2—C49—C54138.9 (4)
O1—Sb1—C16—C17140.0 (4)O4—Sb2—C49—C50130.7 (4)
O2—Sb1—C16—C1742.8 (4)O5—Sb2—C49—C5051.4 (4)
C22—Sb1—C16—C1748.1 (4)C37—Sb2—C49—C50140.2 (4)
C10—Sb1—C16—C17131.3 (4)C43—Sb2—C49—C5040.5 (4)
C21—C16—C17—C180.1 (8)C54—C49—C50—C510.4 (8)
Sb1—C16—C17—C18178.3 (4)Sb2—C49—C50—C51179.0 (4)
C16—C17—C18—C191.2 (9)C49—C50—C51—C521.5 (9)
C17—C18—C19—C200.8 (9)C50—C51—C52—C531.6 (9)
C18—C19—C20—C210.8 (9)C51—C52—C53—C540.1 (8)
C19—C20—C21—C161.9 (9)C50—C49—C54—C532.1 (8)
C17—C16—C21—C201.5 (8)Sb2—C49—C54—C53177.2 (4)
Sb1—C16—C21—C20176.8 (4)C52—C53—C54—C492.0 (8)
 

Follow Acta Cryst. E
Sign up for e-alerts
Follow Acta Cryst. on Twitter
Follow us on facebook
Sign up for RSS feeds