Information card for entry 2228002

Structure parameters

• Chemical name: <i>N</i>-(2-Methoxyphenyl)-4-methylbenzenesulfonamide
• Formula: C14 H15 N O3 S
• Calculated formula: C14 H15 N O3 S
• SMILES: S(=O)(=O)(Nc1c(OC)cccc1)c1ccc(cc1)C
• Title of publication: <i>N</i>-(2-Methoxyphenyl)-4-methylbenzenesulfonamide
• Authors of publication: Khan, Islam Ullah; Sheikh, Tahir Ali; Arshad, Muhammad Nadeem
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2976
• a: 12.7395 ± 0.0009 Å
• b: 11.4906 ± 0.0006 Å
• c: 18.6968 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2736.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1709
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 0.911
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes