Information card for entry 2225467

Structure parameters

• Chemical name: <i>N</i>-(3-Chlorophenyl)succinamic acid
• Formula: C10 H10 Cl N O3
• Calculated formula: C10 H10 Cl N O3
• SMILES: Clc1cc(NC(=O)CCC(=O)O)ccc1
• Title of publication: <i>N</i>-(3-Chlorophenyl)succinamic acid
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Saraswathi, B. S.; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o842
• a: 10.0308 ± 0.0008 Å
• b: 11.181 ± 0.0009 Å
• c: 19.036 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2135 ± 0.3 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1327
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes