Information card for entry 2228544

Structure parameters

• Chemical name: (<i>E</i>)-4-Methoxy-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide methanol monosolvate
• Formula: C16 H17 N3 O5
• Calculated formula: C16 H17 N3 O5
• SMILES: N(=O)(=O)c1ccc(cc1)/C=N/NC(=O)c1ccc(OC)cc1.OC
• Title of publication: (<i>E</i>)-4-Methoxy-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide methanol monosolvate
• Authors of publication: Ban, Hong-Yan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3240
• a: 6.6482 ± 0.0014 Å
• b: 17.73 ± 0.003 Å
• c: 13.898 ± 0.002 Å
• α: 90°
• β: 95.004 ± 0.003°
• γ: 90°
• Cell volume: 1631.9 ± 0.5 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2347
• Residual factor for significantly intense reflections: 0.0805
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.204
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes