Information card for entry 1569536

Structure parameters

• Chemical name: 4-Oxo-<i>N</i>-phenyl-1,4-dihydropyridine-3-carboxamide
• Formula: C12 H10 N2 O2
• Calculated formula: C12 H10 N2 O2
• Title of publication: 4-Oxo-N-phenyl-1,4-dihydropyridine-3-carboxamide
• Authors of publication: Shu, Xi; Long, Sihui
• Journal of publication: IUCrData
• Year of publication: 2023
• Journal volume: 8
• Journal issue: 7
• a: 6.68228 ± 0.0001 Å
• b: 11.79159 ± 0.00018 Å
• c: 13.1717 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1037.86 ± 0.03 ų
• Cell temperature: 275.8 ± 0.2 K
• Ambient diffraction temperature: 275.8 ± 0.2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0322
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No