Information card for entry 2239567

Structure parameters

• Chemical name: <i>N</i>-(3-Chloro-4-ethoxy-1-methyl-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide
• Formula: C17 H18 Cl N3 O4 S
• Calculated formula: C17 H18 Cl N3 O4 S
• SMILES: CCOc1c(ccc2c1c(Cl)nn2C)NS(=O)(=O)c1ccc(cc1)OC
• Title of publication: <i>N</i>-(3-Chloro-4-ethoxy-1-methyl-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide
• Authors of publication: Chicha, Hakima; Rakib, El Mostapha; Hannioui, Abdellah; Saadi, Mohamed; El Ammari, Lahcen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: o679
• a: 8.5296 ± 0.0009 Å
• b: 8.6165 ± 0.0009 Å
• c: 12.9821 ± 0.0014 Å
• α: 91.81 ± 0.006°
• β: 102.566 ± 0.005°
• γ: 100.514 ± 0.005°
• Cell volume: 913.1 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes