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Information card for entry 2208887
Preview
Coordinates | 2208887.cif |
---|---|
Structure factors | 2208887.hkl |
Original IUCr paper | HTML |
Chemical name | Di-μ~2~-chloro-1:2κ^2^Cl,3:4κ^2^Cl-chloro-4κCl-(6-chloropyridine- 3-carboxylato-1κ^2^O,O')octamethyl-1κ^2^C,2κ^2^C,3κ^2^C,4κ^2^C- di-μ~3~-oxo-1:2:3κ^3^O,2:3:4κ^3^O-tetratin(IV) diethyl ether solvate |
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Formula | C18 H37 Cl4 N O5 Sn4 |
Calculated formula | C14 H27 Cl4 N O4 Sn4 |
SMILES | [Sn]12([Cl][Sn]3(C)(C)[O]1[Sn]1([Cl][Sn](Cl)(C)(C)[O]31)(C)C)(C)(C)OC(=[O]2)c1cnc(Cl)cc1 |
Title of publication | Di-μ~2~-chloro-1:2κ^2^<i>Cl</i>,3:4κ^2^<i>Cl</i>-chloro-4κ<i>Cl</i>-(6-chloropyridine-3-carboxylato-1κ^2^<i>O</i>,<i>O</i>')octamethyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>,3κ^2^<i>C</i>,4κ^2^<i>C</i>-di-μ~3~-oxo-1:2:3κ^3^<i>O</i>,2:3:4κ^3^<i>O</i>-tetratin(IV) diethyl ether solvate |
Authors of publication | Fa-Hui li; Han-Dong Yin; Qiang Zhao; Wen-Li Liu |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 5 |
Pages of publication | m1117 - m1118 |
a | 16.123 ± 0.002 Å |
b | 11.0953 ± 0.0015 Å |
c | 20.309 ± 0.003 Å |
α | 90° |
β | 113.059 ± 0.002° |
γ | 90° |
Cell volume | 3342.8 ± 0.8 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0604 |
Residual factor for significantly intense reflections | 0.0319 |
Weighted residual factors for significantly intense reflections | 0.0777 |
Weighted residual factors for all reflections included in the refinement | 0.0887 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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