Information card for entry 2209752

Structure parameters

• Chemical name: (3-Amino-4-chlorobenzoato)trimethyltin(IV)
• Formula: C10 H14 Cl N O2 Sn
• Calculated formula: C10 H14 Cl N O2 Sn
• SMILES: [Sn](OC(=O)c1cc(N)c(Cl)cc1)(C)(C)C
• Title of publication: (3-Amino-4-chlorobenzoato)trimethyltin(IV)
• Authors of publication: Aziz-ur-Rehman; Ali, Saqib; Helliwell, Madeleine; Shahzadi, Saira
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1778 - m1779
• a: 11.9077 ± 0.0007 Å
• b: 9.1237 ± 0.0005 Å
• c: 12.6554 ± 0.0007 Å
• α: 90°
• β: 113.086 ± 0.001°
• γ: 90°
• Cell volume: 1264.8 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0156
• Residual factor for significantly intense reflections: 0.015
• Weighted residual factors for significantly intense reflections: 0.0376
• Weighted residual factors for all reflections included in the refinement: 0.0379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes