Information card for entry 2215151

Structure parameters

• Chemical name: 6-Methoxy-2-(2-pyridylmethyliminomethyl)phenol
• Formula: C14 H14 N2 O2
• Calculated formula: C14 H14 N2 O2
• SMILES: Oc1c(/C=N/Cc2ncccc2)cccc1OC
• Title of publication: 6-Methoxy-2-(2-pyridylmethyliminomethyl)phenol
• Authors of publication: Ni, Zhong-Hai; Wang, Hai-Long
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3799 - o3799
• a: 9.0899 ± 0.0002 Å
• b: 5.6626 ± 0.0001 Å
• c: 24.244 ± 0.0005 Å
• α: 90°
• β: 92.626 ± 0.002°
• γ: 90°
• Cell volume: 1246.59 ± 0.04 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0662
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes