Information card for entry 2210783

Structure parameters

• Common name: chlorpropamide
• Chemical name: 4-chloro-N-(propylaminocarbonyl)benzenesulfonamide
• Formula: C10 H13 Cl N2 O3 S
• Calculated formula: C10 H13 Cl N2 O3 S
• SMILES: S(=O)(=O)(NC(=O)NCCC)c1ccc(Cl)cc1
• Title of publication: A new polymorph of chlorpropamide: 4-chloro-<i>N</i>-(propylaminocarbonyl)benzenesulfonamide
• Authors of publication: Tatiana N. Drebushchak; Nikita V. Chukanov; Elena V. Boldyreva
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: o4393 - o4395
• a: 14.777 ± 0.003 Å
• b: 9.316 ± 0.004 Å
• c: 19.224 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2646.4 ± 1.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1957
• Residual factor for significantly intense reflections: 0.089
• Weighted residual factors for significantly intense reflections: 0.175
• Weighted residual factors for all reflections included in the refinement: 0.2229
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes