Information card for entry 2226098

Structure parameters

• Chemical name: 4-Sulfamoylanilinium chloride
• Formula: C6 H9 Cl N2 O2 S
• Calculated formula: C6 H9 Cl N2 O2 S
• SMILES: S(=O)(=O)(N)c1ccc([NH3+])cc1.[Cl-]
• Title of publication: 4-Sulfamoylanilinium chloride
• Authors of publication: Zaouali Zgolli, Donia; Boughzala, Habib; Driss, Ahmed
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1488
• a: 7.4608 ± 0.0002 Å
• b: 7.7278 ± 0.0002 Å
• c: 31.694 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1827.34 ± 0.13 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P b n b
• Hall space group symbol: -P 2bc 2ab
• Residual factor for all reflections: 0.0733
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1404
• Weighted residual factors for all reflections included in the refinement: 0.1822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes