Information card for entry 2224873

Structure parameters

• Chemical name: (<i>E</i>)-2-[(4-Fluorophenyl)iminomethyl]-5-methoxyphenol
• Formula: C14 H12 F N O2
• Calculated formula: C14 H12 F N O2
• SMILES: c1(c(cc(cc1)OC)O)/C=N/c1ccc(cc1)F
• Title of publication: (<i>E</i>)-2-[(4-Fluorophenyl)iminomethyl]-5-methoxyphenol
• Authors of publication: Albayrak, Çiğdem; Özek, Arzu; Koşar, Başak; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: o315
• a: 13.1806 ± 0.0007 Å
• b: 7.1785 ± 0.0005 Å
• c: 6.4297 ± 0.0003 Å
• α: 90°
• β: 97.967 ± 0.004°
• γ: 90°
• Cell volume: 602.49 ± 0.06 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.038
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.1017
• Weighted residual factors for all reflections included in the refinement: 0.1037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes