Information card for entry 2236103

Structure parameters

• Chemical name: 4-[(<i>E</i>)-(4-Ethoxyphenyl)iminomethyl]phenol
• Formula: C15 H15 N O2
• Calculated formula: C15 H15 N O2
• SMILES: O(c1ccc(/N=C/c2ccc(O)cc2)cc1)CC
• Title of publication: 4-[(<i>E</i>)-(4-Ethoxyphenyl)iminomethyl]phenol
• Authors of publication: Khalaji, Aliakbar Dehno; Fejfarová, Karla; Dušek, Michal
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 9
• Pages of publication: o2646
• a: 10.9155 ± 0.0002 Å
• b: 9.4056 ± 0.0002 Å
• c: 25.0422 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2571 ± 0.09 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0339
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.71
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes