Information card for entry 2232620

Structure parameters

• Chemical name: <i>N</i>'-[(2-Hydroxynaphthalen-1-yl)methylidene]-4-nitrobenzohydrazide
• Formula: C18 H13 N3 O4
• Calculated formula: C18 H13 N3 O4
• SMILES: N(=C\c1c(O)ccc2ccccc12)/NC(=O)c1ccc(N(=O)=O)cc1
• Title of publication: <i>N</i>'-[(2-Hydroxynaphthalen-1-yl)methylidene]-4-nitrobenzohydrazide
• Authors of publication: An, Yan; Li, Xiaofeng; Zhang, Yingjie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3278
• a: 11.208 ± 0.003 Å
• b: 15.432 ± 0.003 Å
• c: 8.982 ± 0.002 Å
• α: 90°
• β: 90.701 ± 0.002°
• γ: 90°
• Cell volume: 1553.4 ± 0.6 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: 0.1311
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1271
• 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