Information card for entry 2230243

Structure parameters

• Chemical name: Tris(2-chlorobenzyl)[3-(4-methylphenyl)prop-2-enoato-κ<i>O</i>]tin(IV)
• Formula: C31 H27 Cl3 O2 Sn
• Calculated formula: C31 H27 Cl3 O2 Sn
• SMILES: [Sn](OC(=O)/C=C/c1ccc(cc1)C)(Cc1ccccc1Cl)(Cc1ccccc1Cl)Cc1ccccc1Cl
• Title of publication: Tris(2-chlorobenzyl)[3-(4-methylphenyl)prop-2-enoato-κ<i>O</i>]tin(IV)
• Authors of publication: Keng, Thy Chun; Lo, Kong Mun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m664
• a: 10.3162 ± 0.0001 Å
• b: 11.0056 ± 0.0001 Å
• c: 13.7555 ± 0.0002 Å
• α: 78.7708 ± 0.0006°
• β: 72.3135 ± 0.0005°
• γ: 86.5793 ± 0.0006°
• Cell volume: 1459.44 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.1
• Weighted residual factors for all reflections included in the refinement: 0.1062
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes