Information card for entry 2238967

Structure parameters

• Chemical name: 2,3-Bis{[2,3-dimethyl-6-(phenylvinyl)phenyl]imino}butane
• Formula: C36 H36 N2
• Calculated formula: C36 H36 N2
• SMILES: CC(=N\c1c(C)c(C)ccc1C(=C)c1ccccc1)/C(=N/c1c(C)c(C)ccc1C(=C)c1ccccc1)C
• Title of publication: 2,3-Bis{[2,3-dimethyl-6-(phenylvinyl)phenyl]imino}butane
• Authors of publication: Zhao, Jie; Yuan, Jianchao; Xu, Weibing; Chen, Jingjing; Mu, Yanqiong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 2
• Pages of publication: o130
• a: 9.613 ± 0.008 Å
• b: 16.285 ± 0.014 Å
• c: 9.639 ± 0.008 Å
• α: 90°
• β: 101.679 ± 0.009°
• γ: 90°
• Cell volume: 1478 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• 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: 0.178
• Residual factor for significantly intense reflections: 0.1034
• Weighted residual factors for significantly intense reflections: 0.2668
• Weighted residual factors for all reflections included in the refinement: 0.3266
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes