Information card for entry 2219460

Structure parameters

• Formula: C14 H13 N O2
• Calculated formula: C14 H13 N O2
• SMILES: Oc1c(/C=N/c2ccccc2)cc(OC)cc1
• Title of publication: 4-Methoxy-2-[(<i>E</i>)-(phenylimino)methyl]phenol
• Authors of publication: Uçan, Selma; Öztürk, Aslı; Sarıkavaklı, Nursabah; Hökelek, Tuncer
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: o1818 - o1819
• a: 20.935 ± 0.002 Å
• b: 4.7151 ± 0.001 Å
• c: 12.276 ± 0.003 Å
• α: 90°
• β: 106.623 ± 0.014°
• γ: 90°
• Cell volume: 1161.1 ± 0.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.2486
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1361
• Weighted residual factors for all reflections included in the refinement: 0.2069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes