Information card for entry 8107425

Structure parameters

• Formula: C54 H58 Cl6 O2 Sn6
• Calculated formula: C54 H58 Cl6 O2 Sn6
• Title of publication: The crystal structure of the cocrystal di-μ 2-chlorido-tetramethyl-tetraphenyl-di-μ 3-oxido-dichloridotetratin(IV) – diphenyl-methyl-chloridotin(IV)(1/2), C54H58Cl6O2Sn6
• Authors of publication: Xiao, Beibei; Xiang, Niping; Yu, Jiangxi; Wang, Chengyong; Liu, Bang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 2
• Pages of publication: 309 - 311
• a: 9.5793 ± 0.0013 Å
• b: 26.161 ± 0.004 Å
• c: 13.1326 ± 0.0018 Å
• α: 90°
• β: 109.124 ± 0.002°
• γ: 90°
• Cell volume: 3109.5 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0423
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No