Information card for entry 1546720

Structure parameters

• Chemical name: Ethyl 1-methyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
• Formula: C13 H13 N O3
• Calculated formula: C13 H13 N O3
• Title of publication: Ethyl 1-methyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
• Authors of publication: Filali Baba, Yassir; Kandri Rodi, Youssef; Hayani, Sonia; Jasinski, Jerry P.; Kaur, Manpreet; Essassi, El Mokhtar
• Journal of publication: IUCrData
• Year of publication: 2017
• Journal volume: 2
• Journal issue: 6
• Pages of publication: x170917
• a: 12.2269 ± 0.0004 Å
• b: 6.7034 ± 0.0003 Å
• c: 14.0817 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1154.16 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0503
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes