Information card for entry 2231228

Structure parameters

• Chemical name: <i>tert</i>-Butyl 1-hydroxypiperidine-2-carboxylate
• Formula: C10 H19 N O3
• Calculated formula: C10 H19 N O3
• SMILES: C(=O)(OC(C)(C)C)C1N(O)CCCC1
• Title of publication: <i>tert</i>-Butyl 1-hydroxypiperidine-2-carboxylate
• Authors of publication: Brücher, Oliver; Bergsträsser, Uwe; Kelm, Harald; Hartung, Jens
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o2061
• a: 10.1685 ± 0.0003 Å
• b: 12.1271 ± 0.0002 Å
• c: 10.2083 ± 0.0003 Å
• α: 90°
• β: 110.377 ± 0.003°
• γ: 90°
• Cell volume: 1180.06 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.058
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1406
• Weighted residual factors for all reflections included in the refinement: 0.1462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes