Information card for entry 2231839

Structure parameters

• Chemical name: <i>N</i>-Cyclohexyl-4-[(2-nitroanilino)methyl]thiophene-2-sulfonamide
• Formula: C17 H21 N3 O4 S2
• Calculated formula: C17 H21 N3 O4 S2
• Title of publication: <i>N</i>-Cyclohexyl-4-[(2-nitroanilino)methyl]thiophene-2-sulfonamide
• Authors of publication: He, Yu-xin; Tong, Rong-sheng; Wu, Jin-wei; Jing, Zou; Shi, Jian-you
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: o2779
• a: 7.4201 ± 0.0002 Å
• b: 27.8329 ± 0.0007 Å
• c: 10.179 ± 0.0003 Å
• α: 90°
• β: 118.44 ± 0.003°
• γ: 90°
• Cell volume: 1848.5 ± 0.1 ų
• Cell temperature: 144.9 K
• Ambient diffraction temperature: 144.9 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0715
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1213
• Weighted residual factors for all reflections included in the refinement: 0.129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes