Information card for entry 2229344

Structure parameters

• Chemical name: Tetrakis[(4-methoxycarbonyl)anilinium] hexachloridostannate(IV) dichloride
• Formula: C32 H40 Cl8 N4 O8 Sn
• Calculated formula: C32 H40 Cl8 N4 O8 Sn
• SMILES: C(=O)(c1ccc(cc1)[NH3+])OC.[NH3+]c1ccc(cc1)C(=O)OC.Cl[Sn]([Cl-])(Cl)(Cl)(Cl)[Cl-].[Cl-].C(=O)(c1ccc(cc1)[NH3+])OC.C(=O)(OC)c1ccc([NH3+])cc1.[Cl-]
• Title of publication: Tetrakis[(4-methoxycarbonyl)anilinium] hexachloridostannate(IV) dichloride
• Authors of publication: Xiao, Wenzhi; Xue, Ruiting; Yin, Yansheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: m297
• a: 30.748 ± 0.003 Å
• b: 7.1172 ± 0.0008 Å
• c: 22.113 ± 0.002 Å
• α: 90°
• β: 119.424 ± 0.002°
• γ: 90°
• Cell volume: 4215 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes