Information card for entry 2236263

Structure parameters

• Chemical name: 2-(4-Bromophenyl)-<i>N</i>-(2,6-dimethylphenyl)acetamide
• Formula: C16 H16 Br N O
• Calculated formula: C16 H16 Br N O
• SMILES: Brc1ccc(cc1)CC(=O)Nc1c(cccc1C)C
• Title of publication: 2-(4-Bromophenyl)-<i>N</i>-(2,6-dimethylphenyl)acetamide
• Authors of publication: Fun, Hoong-Kun; Quah, Ching Kheng; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 9
• Pages of publication: o2678
• a: 4.7146 ± 0.0006 Å
• b: 22.999 ± 0.003 Å
• c: 13.535 ± 0.0015 Å
• α: 90°
• β: 91.138 ± 0.003°
• γ: 90°
• Cell volume: 1467.3 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.1391
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1425
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes