Information card for entry 2219492

Structure parameters

• Chemical name: 4-Chloro-<i>N</i>-(2-chlorophenyl)benzamide
• Formula: C13 H9 Cl2 N O
• Calculated formula: C13 H9 Cl2 N O
• SMILES: Clc1c(NC(=O)c2ccc(Cl)cc2)cccc1
• Title of publication: 4-Chloro-<i>N</i>-(2-chlorophenyl)benzamide
• Authors of publication: Saeed, Aamer; Khera, Rasheed Ahmad; Gotoh, Kazuma; Ishida, Hiroyuki
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o1934
• a: 10.7913 ± 0.0014 Å
• b: 4.8078 ± 0.0006 Å
• c: 23.57 ± 0.003 Å
• α: 90°
• β: 97.718 ± 0.003°
• γ: 90°
• Cell volume: 1211.8 ± 0.3 ų
• Cell temperature: 223 ± 1 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: 0.0864
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1385
• Weighted residual factors for all reflections included in the refinement: 0.1541
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes