Information card for entry 2222908

Structure parameters

• Chemical name: <i>N</i>-(3,4-Dichlorophenyl)-2,4-dimethylbenzenesulfonamide
• Formula: C14 H13 Cl2 N O2 S
• Calculated formula: C14 H13 Cl2 N O2 S
• SMILES: c1(cc(c(cc1)Cl)Cl)NS(=O)(=O)c1c(cc(cc1)C)C
• Title of publication: <i>N</i>-(3,4-Dichlorophenyl)-2,4-dimethylbenzenesulfonamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Nirmala, P. G.; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o1976
• a: 8.8046 ± 0.0007 Å
• b: 9.2688 ± 0.0008 Å
• c: 18.947 ± 0.001 Å
• α: 90°
• β: 99.644 ± 0.008°
• γ: 90°
• Cell volume: 1524.4 ± 0.2 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 303 ± 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: 0.045
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes