Information card for entry 2232963

Structure parameters

• Chemical name: <i>N</i>'-[(<i>E</i>)-Furan-2-ylmethylidene]pyridine-3-carbohydrazide
• Formula: C11 H9 N3 O2
• Calculated formula: C11 H9 N3 O2
• SMILES: O=C(N/N=C/c1occc1)c1cccnc1
• Title of publication: <i>N</i>'-[(<i>E</i>)-Furan-2-ylmethylidene]pyridine-3-carbohydrazide
• Authors of publication: Emmanuel, Jessy; Sithambaresan, M.; Kurup, M. R. Prathapachandra
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3267
• a: 9.441 ± 0.002 Å
• b: 10.237 ± 0.003 Å
• c: 11.023 ± 0.002 Å
• α: 75.1 ± 0.02°
• β: 85.413 ± 0.019°
• γ: 84.11 ± 0.02°
• Cell volume: 1022.5 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0563
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes