Information card for entry 2213332

Structure parameters

• Chemical name: 2'-hydroxyacetophenone furan-2-carbohydrazide
• Formula: C13 H12 N2 O3
• Calculated formula: C13 H12 N2 O3
• SMILES: c1(c(cccc1)O)C(=N/NC(=O)c1ccco1)/C
• Title of publication: 2'-Hydroxyacetophenone furan-2-carbohydrazide
• Authors of publication: Xi-Shi Tai; Jie Yin; Yi-Min Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: o2267 - o2268
• a: 15.602 ± 0.003 Å
• b: 7.7795 ± 0.0014 Å
• c: 9.9721 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1210.4 ± 0.4 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0727
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1279
• Weighted residual factors for all reflections included in the refinement: 0.1327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes