Information card for entry 2240603

Structure parameters

• Common name: (<i>E</i>)-2-Fluorobenzaldehyde (pyridin-2-yl)hydrazone
• Chemical name: 2-[(<i>E</i>)-2-(2-Fluorobenzylidene)hydrazin-1-yl]pyridine
• Formula: C12 H10 F N3
• Calculated formula: C12 H10 F N3
• SMILES: c1(c(F)cccc1)/C=N/Nc1ncccc1
• Title of publication: Crystal structure of (<i>E</i>)-2-fluorobenzaldehyde (pyridin-2-yl)hydrazone
• Authors of publication: Sowmya, Haliwana B. V.; Suresha Kumara, Tholappanavara H.; Jasinski, Jerry P.; Millikan, Sean P.; Glidewell, Christopher
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 5
• Pages of publication: o362 - o363
• a: 3.85166 ± 0.00014 Å
• b: 23.1757 ± 0.0007 Å
• c: 11.4227 ± 0.0004 Å
• α: 90°
• β: 99.278 ± 0.004°
• γ: 90°
• Cell volume: 1006.31 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes