Information card for entry 1569532

Structure parameters

• Chemical name: <i>N</i>-(3-Chloro-2-methylphenyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
• Formula: C13 H11 Cl N2 O2
• Calculated formula: C13 H11 Cl N2 O2
• Title of publication: N-(3-Chloro-2-methylphenyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
• Authors of publication: Tian, Guimiao; Long, Sihui
• Journal of publication: IUCrData
• Year of publication: 2023
• Journal volume: 8
• Journal issue: 7
• a: 4.91237 ± 0.00015 Å
• b: 10.3037 ± 0.0003 Å
• c: 12.5876 ± 0.0003 Å
• α: 105.89 ± 0.002°
• β: 96.422 ± 0.002°
• γ: 99.361 ± 0.002°
• Cell volume: 596.36 ± 0.03 ų
• Cell temperature: 268.1 ± 0.5 K
• Ambient diffraction temperature: 268.1 ± 0.5 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No