Information card for entry 2228233

Structure parameters

• Chemical name: <i>N</i>-(2,3-dichlorophenyl)-2,4-dimethylbenzenesulfonamide
• Formula: C14 H13 Cl2 N O2 S
• Calculated formula: C14 H13 Cl2 N O2 S
• SMILES: Clc1c(NS(=O)(=O)c2c(cc(cc2)C)C)cccc1Cl
• Title of publication: <i>N</i>-(2,3-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: 12
• Pages of publication: o3060
• a: 9.198 ± 0.001 Å
• b: 9.933 ± 0.001 Å
• c: 16.099 ± 0.002 Å
• α: 90°
• β: 99.1 ± 0.001°
• γ: 90°
• Cell volume: 1452.4 ± 0.3 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 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: 0.0458
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes