Information card for entry 7002343

Structure parameters

• Common name: dimethyltin bis-thiobenzoate
• Formula: C16 H16 O2 S2 Sn
• Calculated formula: C16 H16 O2 S2 Sn
• SMILES: C[Sn](SC(=O)c1ccccc1)(SC(=O)c1ccccc1)C
• Title of publication: Synthesis of a one-dimensional coordination polymer containing pendant hydrosulfide groups
• Authors of publication: Chaturvedi, Jyotsna; Bhattacharya, Subrato; Nethaji, M.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 38
• Pages of publication: 8018 - 8024
• a: 10.546 ± 0.003 Å
• b: 14.516 ± 0.004 Å
• c: 12.049 ± 0.004 Å
• α: 90°
• β: 107.702 ± 0.004°
• γ: 90°
• Cell volume: 1757.2 ± 0.9 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.0399
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.3
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No