Information card for entry 7235707

Structure parameters

• Chemical name: 5,6-dimethyl-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: 7.4066 ± 0.0007 Å
• b: 9.4392 ± 0.0012 Å
• c: 9.7203 ± 0.0013 Å
• α: 116.399 ± 0.013°
• β: 97.846 ± 0.009°
• γ: 90.409 ± 0.009°
• Cell volume: 601.24 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1104
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1608
• Weighted residual factors for all reflections included in the refinement: 0.2002
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No