Information card for entry 2218721

Structure parameters

• Chemical name: Bis(5-methylpyrazine-2-carboxylato)diphenyltin(IV)
• Formula: C24 H20 N4 O4 Sn
• Calculated formula: C24 H20 N4 O4 Sn
• SMILES: [Sn]12([n]3c(C(=O)O1)cnc(c3)C)([n]1c(C(=O)O2)cnc(c1)C)(c1ccccc1)c1ccccc1
• Title of publication: Bis(5-methylpyrazine-2-carboxylato)diphenyltin(IV)
• Authors of publication: Gao, Zhongjun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m867
• a: 12.03 ± 0.004 Å
• b: 14.658 ± 0.005 Å
• c: 13.409 ± 0.005 Å
• α: 90°
• β: 91.872 ± 0.004°
• γ: 90°
• Cell volume: 2363.2 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0736
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0881
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes