Information card for entry 2220434

Structure parameters

• Chemical name: (<i>E</i>)-4-Hydroxy-<i>N</i>'-(2-hydroxy-4-methoxybenzylidene)benzohydrazide monohydrate
• Formula: C15 H16 N2 O5
• Calculated formula: C15 H16 N2 O5
• SMILES: Oc1ccc(cc1)C(=O)N/N=C/c1c(O)cc(OC)cc1.O
• Title of publication: (<i>E</i>)-4-Hydroxy-<i>N</i>'-(2-hydroxy-4-methoxybenzylidene)benzohydrazide monohydrate
• Authors of publication: Mohd Lair, Nooraziah; Mohd Ali, Hapipah; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 1
• Pages of publication: o189
• a: 7.1763 ± 0.0002 Å
• b: 16.6507 ± 0.0005 Å
• c: 12.1828 ± 0.0004 Å
• α: 90°
• β: 98.022 ± 0.002°
• γ: 90°
• Cell volume: 1441.48 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1149
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes