Information card for entry 2004209

Structure parameters

• Common name: Tribenzyltin acetate
• Chemical name: Tribenzyltin acetate
• Formula: C23 H24 O2 Sn
• Calculated formula: C23 H24 O2 Sn
• SMILES: O([Sn](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)C(=O)C
• Title of publication: Tribenzyltin Acetate, a Redetermination
• Authors of publication: Ferguson, G.; Spalding, T. R.; O'Dowd, A. T.; O'Shea, K. C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2546 - 2548
• a: 11.3031 ± 0.0008 Å
• b: 10.9569 ± 0.0012 Å
• c: 16.7039 ± 0.0014 Å
• α: 90°
• β: 105.644 ± 0.006°
• γ: 90°
• Cell volume: 1992.1 ± 0.3 ų
• Cell temperature: 294 ± 1 K
• Ambient diffraction temperature: 294 ± 1 K
• Number of distinct elements: 4
• 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: 0.0382
• Residual factor for significantly intense reflections: 0.0261
• Weighted residual factors for all reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.0693
• Goodness-of-fit parameter for all reflections: 1.068
• Goodness-of-fit parameter for significantly intense reflections: 1.153
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No