Information card for entry 2201919

Structure parameters

• Chemical name: 2-Ethyl-3-hydroxy-1-morpholinepyridin-4(1H)-one
• Formula: C11 H16 N2 O3
• Calculated formula: C11 H16 N2 O3
• SMILES: n1(c(c(c(=O)cc1)O)CC)N1CCOCC1
• Title of publication: 2-Ethyl-3-hydroxy-1-morpholinopyridin-4(1<i>H</i>)-one
• Authors of publication: Andreas Decken; David C. Sample; Brock A. Noseworthy; Christopher M. Vogels; Stephen A. Westcott
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: o57 - o58
• a: 8.4379 ± 0.0008 Å
• b: 8.9209 ± 0.0009 Å
• c: 9.3312 ± 0.0012 Å
• α: 64.02 ± 0.003°
• β: 63.198 ± 0.002°
• γ: 66.178 ± 0.002°
• Cell volume: 544.62 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0653
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections included in the refinement: 0.1126
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No