Information card for entry 2215020

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(2-chlorophenyl)benzamide
• Formula: C13 H9 Cl2 N O
• Calculated formula: C13 H9 Cl2 N O
• SMILES: c1(c(cccc1)Cl)C(=O)Nc1c(cccc1)Cl
• Title of publication: 2-Chloro-<i>N</i>-(2-chlorophenyl)benzamide
• Authors of publication: B. Thimme Gowda; Sabine Foro; B. P. Sowmya; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3789 - o3789
• a: 5.9466 ± 0.0005 Å
• b: 9.8323 ± 0.0008 Å
• c: 41.559 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2429.9 ± 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: 0.0887
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.287
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes