Information card for entry 2225885

Structure parameters

• Chemical name: 2-Hydroxy-<i>N</i>'-(2-hydroxy-3-methoxy-5-nitrobenzylidene)- 3-methylbenzohydrazide
• Formula: C16 H15 N3 O6
• Calculated formula: C16 H15 N3 O6
• SMILES: Oc1c(cc(N(=O)=O)cc1OC)/C=N/NC(=O)c1c(O)c(ccc1)C
• Title of publication: 2-Hydroxy-<i>N</i>'-(2-hydroxy-3-methoxy-5-nitrobenzylidene)-3-methylbenzohydrazide
• Authors of publication: Han, You-Yue; Li, Yong-Hong; Zhao, Qiu-Rong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: o1084
• a: 7.482 ± 0.001 Å
• b: 17.158 ± 0.001 Å
• c: 12.25 ± 0.001 Å
• α: 90°
• β: 91.565 ± 0.001°
• γ: 90°
• Cell volume: 1572 ± 0.3 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: 0.0453
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes