Information card for entry 2226894

Structure parameters

• Chemical name: <i>N</i>-(3,4-Dimethylphenyl)benzenesulfonamide
• Formula: C14 H15 N O2 S
• Calculated formula: C14 H15 N O2 S
• SMILES: S(=O)(=O)(Nc1cc(c(cc1)C)C)c1ccccc1
• Title of publication: <i>N</i>-(3,4-Dimethylphenyl)benzenesulfonamide
• Authors of publication: John, Peter; Sharif, Shahzad; Khan, Islam Ullah; Khizar, Saima; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o1983
• a: 24.2129 ± 0.0012 Å
• b: 9.2616 ± 0.0005 Å
• c: 16.5584 ± 0.0016 Å
• α: 90°
• β: 132.014 ± 0.002°
• γ: 90°
• Cell volume: 2758.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.083
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.164
• Weighted residual factors for all reflections included in the refinement: 0.196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes