Information card for entry 2226269

Structure parameters

• Chemical name: <i>N</i>-(2-Chlorophenyl)-2,4-dimethylbenzenesulfonamide
• Formula: C14 H14 Cl N O2 S
• Calculated formula: C14 H14 Cl N O2 S
• SMILES: c1(c(cc(cc1)C)C)S(=O)(=O)Nc1c(cccc1)Cl
• Title of publication: <i>N</i>-(2-Chlorophenyl)-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: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1282
• a: 10.574 ± 0.001 Å
• b: 16.269 ± 0.002 Å
• c: 16.859 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2900.2 ± 0.6 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes