Information card for entry 2205419

Structure parameters

• Chemical name: 3-Hydroxysalicylaldehyde benzoylhydrazone
• Formula: C14 H12 N2 O3
• Calculated formula: C14 H12 N2 O3
• SMILES: Oc1c(O)c(ccc1)/C=N/NC(=O)c1ccccc1
• Title of publication: 3-Hydroxysalicylaldehyde benzoylhydrazone
• Authors of publication: Ali, Hapipah M.; Puvaneswary, Subramaniam; Basirun, Wan Jefri; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: o1013 - o1014
• a: 10.603 ± 0.0006 Å
• b: 9.778 ± 0.0006 Å
• c: 25.203 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2612.9 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes