Information card for entry 2232453

Structure parameters

• Chemical name: 2,4-Dichloro-<i>N</i>-(3,5-dichlorophenyl)benzenesulfonamide
• Formula: C12 H7 Cl4 N O2 S
• Calculated formula: C12 H7 Cl4 N O2 S
• SMILES: c1(c(cc(cc1)Cl)Cl)S(=O)(=O)Nc1cc(cc(c1)Cl)Cl
• Title of publication: 2,4-Dichloro-<i>N</i>-(3,5-dichlorophenyl)benzenesulfonamide
• Authors of publication: Rodrigues, Vinola Z.; Foro, Sabine; Gowda, B. Thimme
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o2976
• a: 8.075 ± 0.001 Å
• b: 9.479 ± 0.001 Å
• c: 10.103 ± 0.002 Å
• α: 84.9 ± 0.02°
• β: 78.49 ± 0.01°
• γ: 79.28 ± 0.01°
• Cell volume: 743.46 ± 0.19 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: 0.0503
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1035
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes