Information card for entry 2239515

Structure parameters

• Chemical name: <i>N</i>-(2-Allyl-4-ethoxy-2<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide
• Formula: C19 H21 N3 O3 S
• Calculated formula: C19 H21 N3 O3 S
• SMILES: CCOc1c(ccc2c1cn(n2)CC=C)NS(=O)(=O)c1ccc(cc1)C
• Title of publication: <i>N</i>-(2-Allyl-4-ethoxy-2<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide
• Authors of publication: Chicha, Hakima; Rakib, El Mostapha; Bouissane, Latifa; Viale, Maurizio; Saadi, Mohamed; El Ammari, Lahcen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: o624
• a: 26.0808 ± 0.0005 Å
• b: 7.9335 ± 0.0002 Å
• c: 21.1573 ± 0.0004 Å
• α: 90°
• β: 122.839 ± 0.001°
• γ: 90°
• Cell volume: 3678.13 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.064
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1236
• Weighted residual factors for all reflections included in the refinement: 0.1338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes