Information card for entry 2238746

Structure parameters

• Chemical name: <i>N</i>-(3-Chloro-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide
• Formula: C14 H12 Cl N3 O3 S
• Calculated formula: C14 H12 Cl N3 O3 S
• SMILES: c1(ccc2c(c1)c(n[nH]2)Cl)NS(=O)(=O)c1ccc(cc1)OC
• Title of publication: <i>N</i>-(3-Chloro-1<i>H</i>-indazol-5-yl)-4-methoxybenzenesulfonamide
• Authors of publication: Chicha, Hakima; Rakib, El Mostapha; Bouissane, Latifa; Saadi, Mohamed; El Ammari, Lahcen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 11
• Pages of publication: o1632
• a: 16.1229 ± 0.0005 Å
• b: 10.0562 ± 0.0003 Å
• c: 9.7955 ± 0.0002 Å
• α: 90°
• β: 105.388 ± 0.001°
• γ: 90°
• Cell volume: 1531.26 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0474
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No