Information card for entry 2239186

Structure parameters

• Chemical name: 2,3-Bis[(3-methylbiphenyl-4-yl)imino]butane
• Formula: C30 H28 N2
• Calculated formula: C30 H28 N2
• SMILES: CC(=N\c1ccc(cc1C)c1ccccc1)/C(=N/c1ccc(cc1C)c1ccccc1)C
• Title of publication: 2,3-Bis[(3-methylbiphenyl-4-yl)imino]butane
• Authors of publication: Chen, Jingjing; Yuan, Jianchao; Zhao, Jie; Xu, Weibing; Mu, Yanqiong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 4
• Pages of publication: o455
• a: 8.347 ± 0.003 Å
• b: 7.063 ± 0.003 Å
• c: 39.946 ± 0.016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2355 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1316
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes