Information card for entry 2227966

Structure parameters

• Chemical name: 2-Methyl-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide
• Formula: C15 H13 N3 O3
• Calculated formula: C15 H13 N3 O3
• SMILES: N(=O)(=O)c1ccc(cc1)C=NNC(=O)c1c(cccc1)C
• Title of publication: 2-Methyl-<i>N</i>'-(4-nitrobenzylidene)benzohydrazide
• Authors of publication: Tang, Chun-Bao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2715
• a: 7.416 ± 0.001 Å
• b: 26.198 ± 0.003 Å
• c: 7.86 ± 0.002 Å
• α: 90°
• β: 114.206 ± 0.001°
• γ: 90°
• Cell volume: 1392.8 ± 0.4 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: 0.1116
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.1401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes