Information card for entry 2218878

Structure parameters

• Chemical name: <i>N</i>-(2-Chlorophenyl)-2-methylbenzamide
• Formula: C14 H12 Cl N O
• Calculated formula: C14 H12 Cl N O
• SMILES: c1(c(cccc1)Cl)NC(=O)c1c(cccc1)C
• Title of publication: <i>N</i>-(2-Chlorophenyl)-2-methylbenzamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Sowmya, B. P.; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: o1421
• a: 4.8881 ± 0.0004 Å
• b: 24.318 ± 0.002 Å
• c: 10.0562 ± 0.0008 Å
• α: 90°
• β: 90.373 ± 0.006°
• γ: 90°
• Cell volume: 1195.34 ± 0.17 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 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: 0.1014
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.2438
• Weighted residual factors for all reflections included in the refinement: 0.3326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.494
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes