Information card for entry 2230122

Structure parameters

• Common name: 3,4-Bis(4-bromophenyl)-<i>N</i>-phenylmaleimide
• Chemical name: 3,4-bis(4-bromophenyl)-1-phenyl-2,5-dihydro-1H-pyrrole-2,5-dione
• Formula: C22 H13 Br2 N O2
• Calculated formula: C22 H13 Br2 N O2
• SMILES: Brc1ccc(cc1)C1=C(C(=O)N(C1=O)c1ccccc1)c1ccc(Br)cc1
• Title of publication: 3,4-Bis(4-bromophenyl)-<i>N</i>-phenylmaleimide
• Authors of publication: Liu, Yong; Zheng, Shuai; Zhou, Jing; Gao, Dongmei; Du, Zhen-Ting
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: o1198
• a: 10.844 ± 0.005 Å
• b: 18.594 ± 0.009 Å
• c: 9.602 ± 0.005 Å
• α: 90°
• β: 102.76 ± 0.006°
• γ: 90°
• Cell volume: 1888.3 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1744
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.0988
• Weighted residual factors for all reflections included in the refinement: 0.1333
• Goodness-of-fit parameter for all reflections included in the refinement: 0.942
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes