Information card for entry 2225794

Structure parameters

• Chemical name: <i>N</i>-(3,5-Dichlorophenyl)-2,4-dimethylbenzenesulfonamide
• Formula: C14 H13 Cl2 N O2 S
• Calculated formula: C14 H13 Cl2 N O2 S
• SMILES: c1(c(cc(cc1)C)C)S(=O)(=O)Nc1cc(cc(c1)Cl)Cl
• Title of publication: <i>N</i>-(3,5-Dichlorophenyl)-2,4-dimethylbenzenesulfonamide
• Authors of publication: Nirmala, P. G.; Gowda, B. Thimme; Foro, Sabine; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: o1090
• a: 23.085 ± 0.003 Å
• b: 8.113 ± 0.002 Å
• c: 16.503 ± 0.003 Å
• α: 90°
• β: 102.03 ± 0.02°
• γ: 90°
• Cell volume: 3022.9 ± 1 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 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: 0.0659
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1751
• Weighted residual factors for all reflections included in the refinement: 0.1886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes