Information card for entry 2223090

Structure parameters

• Chemical name: N'-(4-Hydroxy-3-methoxybenzylidene)-4-methoxybenzohydrazide monohydrate
• Formula: C16 H18 N2 O5
• Calculated formula: C16 H18 N2 O5
• SMILES: O(c1cc(ccc1O)C=NNC(=O)c1ccc(OC)cc1)C.O
• Title of publication: <i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)-4-methoxybenzohydrazide monohydrate
• Authors of publication: Lu, Jiu-Fu; 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: 9
• Pages of publication: o2301
• a: 7.942 ± 0.001 Å
• b: 21.273 ± 0.002 Å
• c: 10.246 ± 0.001 Å
• α: 90°
• β: 106.596 ± 0.002°
• γ: 90°
• Cell volume: 1659 ± 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: 0.0675
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes