Information card for entry 2232192

Structure parameters

• Chemical name: 4-Chloro-<i>N</i>-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide
• Formula: C13 H10 Cl3 N O2 S
• Calculated formula: C13 H10 Cl3 N O2 S
• SMILES: c1(c(cc(cc1)Cl)C)S(=O)(=O)Nc1cc(cc(c1)Cl)Cl
• Title of publication: 4-Chloro-<i>N</i>-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide
• Authors of publication: Rodrigues, Vinola Z.; Foro, Sabine; Gowda, B. Thimme; Shakuntala, K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o3066
• a: 7.9638 ± 0.0008 Å
• b: 8.8494 ± 0.0009 Å
• c: 11.649 ± 0.001 Å
• α: 97.002 ± 0.008°
• β: 102.726 ± 0.009°
• γ: 100.408 ± 0.009°
• Cell volume: 776.35 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0556
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes