Information card for entry 2231303

Structure parameters

• Chemical name: <i>N</i>-(2,6-Dichlorophenyl)succinamic acid
• Formula: C10 H9 Cl2 N O3
• Calculated formula: C10 H9 Cl2 N O3
• SMILES: c1(c(cccc1Cl)Cl)NC(=O)CCC(=O)O
• Title of publication: <i>N</i>-(2,6-Dichlorophenyl)succinamic acid
• Authors of publication: Saraswathi, B. S.; Foro, Sabine; Gowda, B. Thimme
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o1880
• a: 4.713 ± 0.001 Å
• b: 11.963 ± 0.003 Å
• c: 20.687 ± 0.004 Å
• α: 90°
• β: 94.64 ± 0.02°
• γ: 90°
• Cell volume: 1162.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1963
• Residual factor for significantly intense reflections: 0.1187
• Weighted residual factors for significantly intense reflections: 0.1938
• Weighted residual factors for all reflections included in the refinement: 0.2224
• Goodness-of-fit parameter for all reflections included in the refinement: 1.335
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes