Information card for entry 2215122

Structure parameters

• Chemical name: N-(2,4-Dimethylphenyl)benzenesulfonamide
• Formula: C14 H15 N O2 S
• Calculated formula: C14 H15 N O2 S
• SMILES: S(=O)(=O)(Nc1c(cc(C)cc1)C)c1ccccc1
• Title of publication: <i>N</i>-(2,4-Dimethylphenyl)benzenesulfonamide
• Authors of publication: Chang, Jun; Zhang, Tie-Jun; Liu, Chang-Xiao; Zhao, Xue-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3670 - o3670
• a: 7.999 ± 0.003 Å
• b: 11.073 ± 0.004 Å
• c: 15.116 ± 0.005 Å
• α: 90°
• β: 96.822 ± 0.006°
• γ: 90°
• Cell volume: 1329.4 ± 0.8 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.0571
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1224
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes