Information card for entry 2234398

Structure parameters

• Chemical name: 4-Fluoro-2-[(3-methylphenyl)iminomethyl]phenol
• Formula: C14 H12 F N O
• Calculated formula: C14 H12 F N O
• SMILES: Cc1cccc(c1)/N=C/c1cc(F)ccc1O
• Title of publication: 4-Fluoro-2-[(3-methylphenyl)iminomethyl]phenol
• Authors of publication: Brink, Alice; Visser, Hendrik G.; Roodt, Andreas
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: o1071
• a: 10.2655 ± 0.0006 Å
• b: 4.6738 ± 0.0002 Å
• c: 12.3561 ± 0.0008 Å
• α: 90°
• β: 112.331 ± 0.003°
• γ: 90°
• Cell volume: 548.37 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 significantly intense reflections: 0.0343
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes