Information card for entry 2220725

Structure parameters

• Chemical name: <i>N</i>-(2,3-Dimethylphenyl)benzenesulfonamide
• Formula: C14 H15 N O2 S
• Calculated formula: C14 H15 N O2 S
• SMILES: c1(ccccc1)S(=O)(=O)Nc1c(c(ccc1)C)C
• Title of publication: <i>N</i>-(2,3-Dimethylphenyl)benzenesulfonamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Babitha, K. S.; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o366
• a: 6.3969 ± 0.0005 Å
• b: 8.8767 ± 0.0006 Å
• c: 23.082 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1310.67 ± 0.18 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0434
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes