Information card for entry 2217095

Structure parameters

• Chemical name: (6E)-N-[(4Z)-2,5-Dimethyl-4-(p-tolylimino)cyclohexa-2,5-dienylidene]-4- methylaniline
• Formula: C22 H22 N2
• Calculated formula: C22 H22 N2
• SMILES: CC1=CC(=N\c2ccc(cc2)C)/C(=C/C1=N\c1ccc(cc1)C)C
• Title of publication: (6<i>E</i>)-<i>N</i>-[(4<i>Z</i>)-2,5-Dimethyl-4-(<i>p</i>-tolylimino)cyclohexa-2,5-dienylidene]-4-methylaniline
• Authors of publication: Fang-Fang Jian; Rui-Rui Zhuang; Ke-Fei Wang; Jing Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o78 - o78
• a: 21.173 ± 0.008 Å
• b: 21.173 ± 0.008 Å
• c: 10.476 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4067 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1841
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.1841
• Weighted residual factors for all reflections included in the refinement: 0.2325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes