Information card for entry 2202030

Structure parameters

• Chemical name: aquatrifluoroacetatotriphenyltin.2,2'-bipyridine
• Formula: C30 H25 F3 N2 O3 Sn
• Calculated formula: C30 H25 F3 N2 O3 Sn
• SMILES: [Sn](OC(=O)C(F)(F)F)([OH2])(c1ccccc1)(c1ccccc1)c1ccccc1.n1ccccc1c1ncccc1
• Title of publication: Aqua(trifluoroacetato)triphenyltin‒2,2'-bipyridine (2/2)
• Authors of publication: Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica, Section E: Structure Reports Online
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 4
• Pages of publication: m205 - m206
• a: 11.556 ± 0.001 Å
• b: 11.662 ± 0.001 Å
• c: 12.387 ± 0.001 Å
• α: 101.524 ± 0.001°
• β: 101.037 ± 0.001°
• γ: 117.313 ± 0.001°
• Cell volume: 1374.3 ± 0.2 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.034
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 2238962
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No