Information card for entry 2005119

Structure parameters

• Chemical name: trans-dimethyl-cis-dicloro-μ-bis{meso-1,2-di(phenylsulphinyl)ethane}-tin(IV)
• Formula: C16 H20 Cl2 O2 S2 Sn
• Calculated formula: C16 H20 Cl2 O2 S2 Sn
• SMILES: [Sn](C)(C)(Cl)(Cl)([O]=S(c1ccccc1)CCS(c1ccccc1)=O)[O]=S(c1ccccc1)CCS(c1ccccc1)=[O][Sn](C)(C)(Cl)Cl
• Title of publication: <i>catena</i>-Poly[<i>cis</i>-dichloro-<i>trans</i>-dimethyltin(IV)-μ-<i>meso</i>-1,2-bis(phenylsulfinyl)ethane-<i>O</i>:<i>O</i>']
• Authors of publication: Carvalho, C. C.; Francisco, R. H. P.; do Gambardella, M. T.; de Sousa, G. F.; Filgueiras, C. A. L.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 7
• Pages of publication: 1629 - 1631
• a: 16.445 ± 0.002 Å
• b: 6.3075 ± 0.0006 Å
• c: 21.092 ± 0.003 Å
• α: 90°
• β: 112.02 ± 0.01°
• γ: 90°
• Cell volume: 2028.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for all reflections: 0.1008
• Weighted residual factors for significantly intense reflections: 0.0836
• Goodness-of-fit parameter for all reflections: 1.09
• Goodness-of-fit parameter for significantly intense reflections: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No