Information card for entry 2214336

Structure parameters

• Common name: Methanesulfon-2,3-dichloroanilide
• Chemical name: N-(2,3-dichlorophenyl)methanesulfonamide
• Formula: C7 H7 Cl2 N O2 S
• Calculated formula: C7 H7 Cl2 N O2 S
• SMILES: CS(=O)(=O)Nc1cccc(c1Cl)Cl
• Title of publication: <i>N</i>-(2,3-Dichlorophenyl)methanesulfonamide
• Authors of publication: B. Thimme Gowda; Sabine Foro; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: o3086 - o3086
• a: 11.1299 ± 0.0009 Å
• b: 5.1365 ± 0.0006 Å
• c: 16.908 ± 0.001 Å
• α: 90°
• β: 90.038 ± 0.006°
• γ: 90°
• Cell volume: 966.61 ± 0.15 ų
• Cell temperature: 303 ± 2 K
• Ambient diffraction temperature: 303 ± 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: 0.0579
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.146
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 0.866
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes