Information card for entry 2224116

Structure parameters

• Chemical name: 3-Hydroxy-<i>N'</i>-(5-hydroxy-2-nitrobenzylidene)-2-naphthohydrazide
• Formula: C18 H13 N3 O5
• Calculated formula: C18 H13 N3 O5
• SMILES: N(N=Cc1c(N(=O)=O)ccc(O)c1)C(=O)c1c(O)cc2ccccc2c1
• Title of publication: 3-Hydroxy-<i>N</i>'-(5-hydroxy-2-nitrobenzylidene)-2-naphthohydrazide
• Authors of publication: Yang, De-Suo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: o2978
• a: 10.1588 ± 0.0003 Å
• b: 8.2562 ± 0.0002 Å
• c: 19.5268 ± 0.0005 Å
• α: 90°
• β: 104.867 ± 0.001°
• γ: 90°
• Cell volume: 1582.95 ± 0.07 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: 0.0639
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.1187
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes