Information card for entry 2213811

Structure parameters

• Chemical name: μ-Fumarato-κ^2^O,O'-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]
• Formula: C64 H80 O4 Sn2
• Calculated formula: C64 H80 O4 Sn2
• SMILES: C(=O)(O[Sn](CC(C)(c1ccccc1)C)(CC(C)(C)c1ccccc1)CC(C)(c1ccccc1)C)/C=C/C(=O)O[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c1ccccc1)CC(C)(C)c1ccccc1
• Title of publication: μ-Fumarato-κ^2^<i>O</i>:<i>O</i>'-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]
• Authors of publication: Liu, Xi-Cheng; Yin, Ling; Sun, Yu-Xi; Tian, Lai-Jin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1758 - m1758
• a: 9.6017 ± 0.0009 Å
• b: 18.6352 ± 0.0018 Å
• c: 16.5097 ± 0.0016 Å
• α: 90°
• β: 91.985 ± 0.001°
• γ: 90°
• Cell volume: 2952.3 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• 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: 0.0581
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.1009
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes