Information card for entry 2219834

Structure parameters

• Chemical name: <i>N</i>'-[4-(2-Furyl)but-3-en-2-ylidene]isonicotinohydrazide
• Formula: C14 H13 N3 O2
• Calculated formula: C14 H13 N3 O2
• SMILES: c1ccc(/C=C/C(=N/NC(=O)c2ccncc2)C)o1
• Title of publication: <i>N</i>'-[4-(2-Furyl)but-3-en-2-ylidene]isonicotinohydrazide
• Authors of publication: Yin, Zhi-Gang; Chen, Yu-Zhen; Qian, Heng-Yu; Hu, Jie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: o2148
• a: 16.6325 ± 0.0014 Å
• b: 9.3572 ± 0.0008 Å
• c: 8.3554 ± 0.0007 Å
• α: 90°
• β: 100.912 ± 0.001°
• γ: 90°
• Cell volume: 1276.87 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes