Information card for entry 2237217

Structure parameters

• Chemical name: <i>N</i>-(2,3-Dichlorophenyl)-2-nitrobenzenesulfonamide
• Formula: C12 H8 Cl2 N2 O4 S
• Calculated formula: C12 H8 Cl2 N2 O4 S
• SMILES: c1(c(cccc1)N(=O)=O)S(=O)(=O)Nc1c(c(ccc1)Cl)Cl
• Title of publication: <i>N</i>-(2,3-Dichlorophenyl)-2-nitrobenzenesulfonamide
• Authors of publication: Chaithanya, U.; Foro, Sabine; Gowda, B. Thimme
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 1
• Pages of publication: o76
• a: 8.2197 ± 0.0005 Å
• b: 15.863 ± 0.001 Å
• c: 11.0108 ± 0.0006 Å
• α: 90°
• β: 93.45 ± 0.006°
• γ: 90°
• Cell volume: 1433.09 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes