Information card for entry 2226783

Structure parameters

• Chemical name: 2-Methyl-<i>N</i>-(2-methylbenzoyl)benzenesulfonamide
• Formula: C15 H15 N O3 S
• Calculated formula: C15 H15 N O3 S
• SMILES: Cc1ccccc1C(=O)NS(=O)(=O)c1ccccc1C
• Title of publication: 2-Methyl-<i>N</i>-(2-methylbenzoyl)benzenesulfonamide
• Authors of publication: Suchetan, P. A.; Gowda, B. Thimme; Foro, Sabine; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o1992
• a: 13.997 ± 0.001 Å
• b: 14.165 ± 0.001 Å
• c: 14.395 ± 0.002 Å
• α: 90°
• β: 96.955 ± 0.008°
• γ: 90°
• Cell volume: 2833.1 ± 0.5 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0482
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes