Information card for entry 2202246

Structure parameters

• Chemical name: μ-Succinato-bis(aquatriphenyltin) bis(o-phenanthroline)
• Formula: C64 H54 N4 O6 Sn2
• Calculated formula: C64 H54 N4 O6 Sn2
• SMILES: c1(ccccc1)[Sn](c1ccccc1)(OC(=O)CCC(=O)O[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.n1cccc2ccc3cccnc3c12.O.n1cccc2ccc3cccnc3c12.O
• Title of publication: μ-Succinato-bis(aquatriphenyltin)bis(<i>o</i>-phenanthroline)
• Authors of publication: Chee, Chin Fei; Lo, Kong Mun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: m36 - m37
• a: 13.5958 ± 0.0008 Å
• b: 13.6077 ± 0.0008 Å
• c: 14.4444 ± 0.0009 Å
• α: 90°
• β: 101.014 ± 0.001°
• γ: 90°
• Cell volume: 2623.1 ± 0.3 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 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: 0.022
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes