Information card for entry 2235250

Structure parameters

• Chemical name: 4-Methoxy-<i>N</i>'-(3-nitrobenzylidene)benzohydrazide
• Formula: C15 H13 N3 O4
• Calculated formula: C15 H13 N3 O4
• SMILES: O=N(=O)c1cc(ccc1)/C=N/NC(=O)c1ccc(OC)cc1
• Title of publication: 4-Methoxy-<i>N</i>'-(3-nitrobenzylidene)benzohydrazide
• Authors of publication: Hou, Jin-Long; Bi, Ye
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: o1725
• a: 6.8472 ± 0.0017 Å
• b: 4.8269 ± 0.0016 Å
• c: 21.414 ± 0.003 Å
• α: 90°
• β: 96.696 ± 0.002°
• γ: 90°
• Cell volume: 702.9 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0404
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes