Information card for entry 2244056

Structure parameters

• Chemical name: 2-(2-Hydroxyphenyl)quinoline-6-sulfonamide
• Formula: C15 H12 N2 O3 S
• Calculated formula: C15 H12 N2 O3 S
• SMILES: S(=O)(=O)(N)c1cc2c(nc(c3c(O)cccc3)cc2)cc1
• Title of publication: Crystal structure and Hirshfeld surface analysis of 2-(2-hydroxyphenyl)quinoline-6-sulfonamide
• Authors of publication: Benarous, Nesrine; Moussa Slimane, Nabila; Bougueria, Hassiba; Boutebdja, Mehdi; Cherouana, Aouatef
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2022
• Journal volume: 78
• Journal issue: 4
• a: 5.7667 ± 0.0002 Å
• b: 28.4129 ± 0.0007 Å
• c: 15.5339 ± 0.0005 Å
• α: 90°
• β: 91.728 ± 0.003°
• γ: 90°
• Cell volume: 2544.05 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.092
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1562
• Weighted residual factors for all reflections included in the refinement: 0.1838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes