Information card for entry 2235796

Structure parameters

• Chemical name: 2-Ethoxy-6-({2-[(3-ethoxy-2-hydroxybenzylidene)amino]benzyl}iminomethyl)phenol
• Formula: C25 H26 N2 O4
• Calculated formula: C25 H26 N2 O4
• SMILES: O(CC)c1cccc(c1O)/C=N/Cc1ccccc1/N=C/c1cccc(OCC)c1O
• Title of publication: 2-Ethoxy-6-({2-[(3-ethoxy-2-hydroxybenzylidene)amino]benzyl}iminomethyl)phenol
• Authors of publication: Ambili, K. U.; Sreejith, S. S.; Jacob, Jinsa Mary; Sithambaresan, M.; Kurup, M. R. Prathapachandra
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: o2482
• a: 4.8315 ± 0.0004 Å
• b: 17.5414 ± 0.0014 Å
• c: 25.828 ± 0.002 Å
• α: 90°
• β: 94.356 ± 0.003°
• γ: 90°
• Cell volume: 2182.6 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0715
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes