Information card for entry 2238666

Structure parameters

• Chemical name: 4,6-Dibromo-<i>N</i>-{3-[(4,6-dibromo-2,3-dimethylphenyl)imino]butan-2-ylidene}-2,3-dimethylaniline
• Formula: C20 H20 Br4 N2
• Calculated formula: C20 H20 Br4 N2
• SMILES: CC(=N\c1c(Br)cc(c(c1C)C)Br)/C(=N/c1c(Br)cc(c(c1C)C)Br)C
• Title of publication: 4,6-Dibromo-<i>N</i>-{3-[(4,6-dibromo-2,3-dimethylphenyl)imino]butan-2-ylidene}-2,3-dimethylaniline
• Authors of publication: Huang, Lina; Du, Zhengyin; Liu, Wei; Che, Fushou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 10
• Pages of publication: o1496
• a: 5.5582 ± 0.0006 Å
• b: 12.8881 ± 0.0015 Å
• c: 14.8377 ± 0.0011 Å
• α: 90°
• β: 98.782 ± 0.008°
• γ: 90°
• Cell volume: 1050.43 ± 0.19 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1311
• Weighted residual factors for all reflections included in the refinement: 0.1345
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No