Information card for entry 2221424

Structure parameters

• Chemical name: 4-(2,3,4-Trimethoxy-6-methylbenzylideneamino)phenol
• Formula: C17 H19 N O4
• Calculated formula: C17 H19 N O4
• SMILES: COc1c(/C=N/c2ccc(cc2)O)c(C)cc(c1OC)OC
• Title of publication: 4-(2,3,4-Trimethoxy-6-methylbenzylideneamino)phenol
• Authors of publication: Wang, Cheng-Yun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o741
• a: 20.045 ± 0.002 Å
• b: 13.2042 ± 0.0019 Å
• c: 24.253 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6419.2 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• 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: 0.1661
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1311
• Weighted residual factors for all reflections included in the refinement: 0.2061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes