Information card for entry 2224201

Structure parameters

• Chemical name: 2-(4-Pyridylmethoxy)phenol
• Formula: C12 H11 N O2
• Calculated formula: C12 H11 N O2
• SMILES: c1cnccc1COc1ccccc1O
• Title of publication: 2-(4-Pyridylmethoxy)phenol
• Authors of publication: Zhang, Zhi; Li, Yu-Jie; Gao, Xue-Mei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o3160
• a: 11.8 ± 0.003 Å
• b: 9.114 ± 0.004 Å
• c: 19.041 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2047.8 ± 1.3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 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: 0.103
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1268
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes