Information card for entry 2224254

Structure parameters

• Chemical name: (Dimethyl sulfoxide-κ<i>O</i>)diphenyl(3-thioxo-3<i>H</i>-1,2-dithiole-4,5-dithiolato- κ^2^<i>S</i>^4^,<i>S</i>^5^)tin(IV)
• Formula: C17 H16 O S6 Sn
• Calculated formula: C17 H16 O S6 Sn
• SMILES: [Sn]1(SC2=C(S1)SSC2=S)([O]=S(C)C)(c1ccccc1)c1ccccc1
• Title of publication: (Dimethyl sulfoxide-κ<i>O</i>)diphenyl(3-thioxo-3<i>H</i>-1,2-dithiole-4,5-dithiolato-κ^2^<i>S</i>^4^,<i>S</i>^5^)tin(IV)
• Authors of publication: Comerlato, Nadia M.; Tiekink, Edward R. T.; Wardell, James L.; Wardell, Solange M. S. V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1592 - m1593
• a: 11.142 ± 0.0005 Å
• b: 15.7237 ± 0.0006 Å
• c: 11.9646 ± 0.0006 Å
• α: 90°
• β: 96.892 ± 0.002°
• γ: 90°
• Cell volume: 2080.97 ± 0.16 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.05
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes