Information card for entry 8103262

Structure parameters

• Chemical name: 3-cyclohexyl-1,3-oxazinan-2-one
• Formula: C10 H17 N O2
• Calculated formula: C10 H17 N O2
• Title of publication: Crystal structure of 3-cyclohexyl-1,3-oxazinan-2-one, C10H17NO2
• Authors of publication: Ana Miltojeviƒ; Niko Radulovic; Rastko D. Vukicevic; Srecko Trifunovic; Horst Borrmann
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 651
• a: 10.1872 ± 0.001 Å
• b: 9.8426 ± 0.0008 Å
• c: 10.7655 ± 0.0011 Å
• α: 90°
• β: 113.589 ± 0.004°
• γ: 90°
• Cell volume: 989.24 ± 0.16 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 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: 0.0672
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.1429
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No