Information card for entry 2224493

Structure parameters

• Chemical name: (<i>E</i>)-2-Methoxy-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide
• Formula: C15 H13 N3 O4
• Calculated formula: C15 H13 N3 O4
• SMILES: N(=C\c1ccc(N(=O)=O)cc1)/NC(=O)c1c(OC)cccc1
• Title of publication: (<i>E</i>)-2-Methoxy-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide
• Authors of publication: Ban, Hong-Yan; Li, Cong-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o3272
• a: 11.1843 ± 0.0002 Å
• b: 11.3718 ± 0.0003 Å
• c: 13.0519 ± 0.0002 Å
• α: 90°
• β: 121.792 ± 0.002°
• γ: 90°
• Cell volume: 1410.96 ± 0.06 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: 0.0756
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes