Information card for entry 2223327

Structure parameters

• Chemical name: <i>N</i>'-(3-Ethoxy-2-hydroxybenzylidene)-4-hydroxy-3-methoxybenzohydrazide monohydrate
• Formula: C17 H20 N2 O6
• Calculated formula: C17 H20 N2 O6
• SMILES: N(=C\c1c(O)c(OCC)ccc1)/NC(=O)c1cc(OC)c(O)cc1.O
• Title of publication: <i>N</i>'-(3-Ethoxy-2-hydroxybenzylidene)-4-hydroxy-3-methoxybenzohydrazide monohydrate
• Authors of publication: Lu, Jiu-Fu; Bai, Yue-Fei; Min, Suo-Tian; Ge, Hong-Guang; Ji, Xiao-Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: o2316
• a: 9.4063 ± 0.0011 Å
• b: 10.0598 ± 0.0012 Å
• c: 17.667 ± 0.002 Å
• α: 90°
• β: 93.702 ± 0.002°
• γ: 90°
• Cell volume: 1668.3 ± 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: 0.0632
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes