Information card for entry 2234889

Structure parameters

• Common name: 2,6-dichloro-<i>N</i>-(4-methylphenyl)benzamide
• Chemical name: 2,6-Dichloro-<i>N</i>-(4-methylphenyl)benzamide
• Formula: C14 H11 Cl2 N O
• Calculated formula: C14 H11 Cl2 N O
• SMILES: N(c1ccc(C)cc1)C(=O)c1c(Cl)cccc1Cl
• Title of publication: 2,6-Dichloro-<i>N</i>-(4-methylphenyl)benzamide
• Authors of publication: Wei, Peng-Fei; Hao, Ling-Yun; Yang, Xiao-Li; Ye, Yuan-Feng; Feng, Zhi-Qiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: o1417
• a: 11.26 ± 0.002 Å
• b: 12.786 ± 0.003 Å
• c: 9.67 ± 0.0019 Å
• α: 90°
• β: 100.65 ± 0.03°
• γ: 90°
• Cell volume: 1368.2 ± 0.5 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1021
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1241
• Weighted residual factors for all reflections included in the refinement: 0.15
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes