Information card for entry 2216112

Structure parameters

• Chemical name: 2-Methoxy-6-[(4-methylpyridin-2-ylimino)methyl]phenol
• Formula: C14 H14 N2 O2
• Calculated formula: C14 H14 N2 O2
• SMILES: Oc1c(cccc1OC)/C=N/c1nccc(c1)C
• Title of publication: 2-Methoxy-6-[(4-methylpyridin-2-yl)iminomethyl]phenol
• Authors of publication: He-Bing Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: o4246 - o4246
• a: 9.997 ± 0.002 Å
• b: 4.896 ± 0.001 Å
• c: 24.729 ± 0.005 Å
• α: 90°
• β: 94.24 ± 0.03°
• γ: 90°
• Cell volume: 1207.1 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1153
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1327
• Weighted residual factors for all reflections included in the refinement: 0.1592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes