Information card for entry 2213756

Structure parameters

• Chemical name: (±)-1-{[(4-Methoxybenzylidene)amino](4-methoxyphenyl)methyl}-2-naphthol
• Formula: C26 H23 N O3
• Calculated formula: C26 H23 N O3
• SMILES: C(c1c2ccccc2ccc1O)(\N=C\c1ccc(OC)cc1)c1ccc(OC)cc1
• Title of publication: (±)-1-{[(4-Methoxybenzylidene)amino](4-methoxyphenyl)methyl}-2-naphthol
• Authors of publication: Huang, Xian-Tong; Kan, Lin; Ji, Tao; Tang, Guo; Zhao, Yu-Fen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: o3031 - o3031
• a: 20.79 ± 0.005 Å
• b: 10.717 ± 0.003 Å
• c: 9.47 ± 0.002 Å
• α: 90°
• β: 102.952 ± 0.004°
• γ: 90°
• Cell volume: 2056.3 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• 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: 0.0815
• Residual factor for significantly intense reflections: 0.0714
• Weighted residual factors for significantly intense reflections: 0.151
• Weighted residual factors for all reflections included in the refinement: 0.1562
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes