Information card for entry 2210428

Structure parameters

• Chemical name: (E)-6-fluoropyridine-2-carbaldehyde oxime
• Formula: C6 H5 F N2 O
• Calculated formula: C6 H5 F N2 O
• SMILES: Fc1nc(ccc1)/C=N/O
• Title of publication: (<i>E</i>)-6-Fluoropyridine-2-carbaldehyde oxime
• Authors of publication: Zhou, Fu-Hui; Gu, Xiao-Dan; Zhou, Hua; Xu, Jing-Wei; Zhao, Hong-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3959 - o3960
• a: 8.006 ± 0.002 Å
• b: 8.525 ± 0.002 Å
• c: 9.26 ± 0.002 Å
• α: 90°
• β: 91.998 ± 0.005°
• γ: 90°
• Cell volume: 631.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.149
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes