Information card for entry 2234869

Structure parameters

• Chemical name: (<i>E</i>)-2,4,6-Trimethyl-<i>N</i>-(pyridin-2-ylmethylidene)aniline
• Formula: C15 H16 N2
• Calculated formula: C15 H16 N2
• SMILES: n1c(cccc1)/C=N/c1c(cc(cc1C)C)C
• Title of publication: (<i>E</i>)-2,4,6-Trimethyl-<i>N</i>-(pyridin-2-ylmethylidene)aniline
• Authors of publication: Dong, Yu-Wei; Fan, Rui-Qing; Wang, Ping; Yang, Yu-Lin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: o1427
• a: 8.249 ± 0.0016 Å
• b: 16.136 ± 0.003 Å
• c: 10.15 ± 0.002 Å
• α: 90°
• β: 104.76 ± 0.03°
• γ: 90°
• Cell volume: 1306.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0765
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1764
• Weighted residual factors for all reflections included in the refinement: 0.2002
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes