Information card for entry 2210433

Structure parameters

• Chemical name: N-(4-bromobenzyl)phthaimide
• Formula: C15 H10 Br N O2
• Calculated formula: C15 H10 Br N O2
• SMILES: Brc1ccc(CN2C(=O)c3ccccc3C2=O)cc1
• Title of publication: <i>N</i>-(4-Bromobenzyl)phthalimide
• Authors of publication: Chen, Ping; Zhang, Ling; Li, Dan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3691 - o3692
• a: 13.086 ± 0.003 Å
• b: 14.174 ± 0.003 Å
• c: 7.1967 ± 0.0014 Å
• α: 90°
• β: 103.701 ± 0.003°
• γ: 90°
• Cell volume: 1296.9 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.098
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes