Information card for entry 2204872

Structure parameters

• Chemical name: μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]
• Formula: C68 H82 O4 Sn2
• Calculated formula: C68 H82 O4 Sn2
• SMILES: [Sn](OC(=O)c1ccccc1C(=O)O[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c1ccccc1)CC(C)(C)c1ccccc1)(CC(C)(C)c1ccccc1)(CC(C)(C)c1ccccc1)CC(C)(C)c1ccccc1
• Title of publication: μ-Phthalato-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]
• Authors of publication: Tian, Lai-Jin; Sun, Yu-Xi; Yang, Min; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m74 - m75
• a: 9.5514 ± 0.0004 Å
• b: 18.0919 ± 0.0008 Å
• c: 35.497 ± 0.002 Å
• α: 90°
• β: 95.17 ± 0.001°
• γ: 90°
• Cell volume: 6109 ± 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: 0.0866
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes