Information card for entry 2207349

Structure parameters

• Chemical name: (E)-N'-(3-Hydroxy-4-methoxybenzylidene)isonicotinohydrazide
• Formula: C14 H13 N3 O3
• Calculated formula: C14 H13 N3 O3
• SMILES: O(c1ccc(/C=N/NC(=O)c2ccncc2)cc1O)C
• Title of publication: (<i>E</i>)<i>-N</i>'-(3-Hydroxy-4-methoxybenzylidene)isonicotinohydrazide
• Authors of publication: Shi Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: o3935 - o3936
• a: 11.516 ± 0.003 Å
• b: 15.44 ± 0.004 Å
• c: 7.977 ± 0.002 Å
• α: 90°
• β: 109.548 ± 0.005°
• γ: 90°
• Cell volume: 1336.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1392
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.0673
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes