Information card for entry 2224645

Structure parameters

• Chemical name: 2-(4-Bromophenyl)-N-(2-methoxyphenyl)acetamide
• Formula: C15 H14 Br N O2
• Calculated formula: C15 H14 Br N O2
• SMILES: Brc1ccc(cc1)CC(=O)Nc1c(cccc1)OC
• Title of publication: 2-(4-Bromophenyl)-<i>N</i>-(2-methoxyphenyl)acetamide
• Authors of publication: Xiao, Zhu-Ping; Ouyang, Yu-Zhu; Qin, Shi-Dong; Xie, Tian; Yang, Jia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: o67
• a: 4.851 ± 0.004 Å
• b: 12.083 ± 0.01 Å
• c: 12.265 ± 0.01 Å
• α: 74.61 ± 0.03°
• β: 87.47 ± 0.03°
• γ: 85.18 ± 0.03°
• Cell volume: 690.5 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.118
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes