Information card for entry 2239456

Structure parameters

• Chemical name: <i>N</i>'-[(<i>E</i>)-Furan-2-ylmethylidene]-4-hydroxybenzohydrazide
• Formula: C12 H10 N2 O3
• Calculated formula: C12 H10 N2 O3
• SMILES: Oc1ccc(cc1)C(=O)N/N=C/c1ccco1
• Title of publication: <i>N</i>'-[(<i>E</i>)-Furan-2-ylmethylidene]-4-hydroxybenzohydrazide
• Authors of publication: Datta, Riya; Ramya, V.; Sithambaresan, M.; Kurup, M. R. Prathapachandra
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 3
• Pages of publication: o242
• a: 9.5934 ± 0.0003 Å
• b: 11.1939 ± 0.0004 Å
• c: 10.3332 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1109.66 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0634
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes