Information card for entry 7235708

Structure parameters

• Chemical name: 6-ethyl-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
• Formula: C14 H12 N2 O
• Calculated formula: C14 H12 N2 O
• Title of publication: Cascade synthesis of 2-pyridones using acrylamides and ketones
• Authors of publication: Rai, Sunil K.; Khanam, Shaziya; Khanna, Ranjana S.; Tewari, Ashish K.
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 83
• Pages of publication: 44141
• a: 7.3809 ± 0.0006 Å
• b: 8.0626 ± 0.0006 Å
• c: 19.9265 ± 0.0012 Å
• α: 90°
• β: 98.378 ± 0.006°
• γ: 90°
• Cell volume: 1173.16 ± 0.15 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: 0.1204
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1581
• Weighted residual factors for all reflections included in the refinement: 0.1905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No