Information card for entry 2218625

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-(2,3,4-Trimethoxy-6-methylbenzylidene)aniline
• Formula: C17 H19 N O3
• Calculated formula: C17 H19 N O3
• SMILES: N(=C/c1c(OC)c(OC)c(OC)cc1C)\c1ccccc1
• Title of publication: (<i>E</i>)-<i>N</i>-(2,3,4-Trimethoxy-6-methylbenzylidene)aniline
• Authors of publication: Zhang, Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: o1219
• a: 8.3126 ± 0.0013 Å
• b: 9.9938 ± 0.0017 Å
• c: 10.8661 ± 0.0019 Å
• α: 110.102 ± 0.002°
• β: 111.995 ± 0.002°
• γ: 92.7 ± 0.001°
• Cell volume: 769.8 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0932
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes