Information card for entry 2207486

Structure parameters

• Chemical name: tert-Butyl 4,4-dimethyl-5-oxo-1,3-oxazolidine-3-carboxylate
• Formula: C10 H17 N O4
• Calculated formula: C10 H17 N O4
• SMILES: CC(C)(C)OC(=O)N1C(C)(C)C(=O)OC1
• Title of publication: <i>tert</i>-Butyl 4,4-dimethyl-5-oxo-1,3-oxazolidine-3-carboxylate
• Authors of publication: D. Gayathri; D. Velmurugan; Kantharaju; V.V. Suresh Babu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: o4088 - o4090
• a: 10.8869 ± 0.0009 Å
• b: 6.1138 ± 0.0005 Å
• c: 17.3497 ± 0.0014 Å
• α: 90°
• β: 90.182 ± 0.007°
• γ: 90°
• Cell volume: 1154.8 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes