Information card for entry 2220845

Structure parameters

• Chemical name: <i>tert</i>-Butyl 3-carbamoyl-4-methoxyimino-3-methylpiperidine-1-carboxylate
• Formula: C13 H23 N3 O4
• Calculated formula: C13 H23 N3 O4
• SMILES: N1(C(=O)OC(C)(C)C)CC(C(=N\OC)\CC1)(C(=O)N)C
• Title of publication: <i>tert</i>-Butyl 3-carbamoyl-4-methoxyimino-3-methylpiperidine-1-carboxylate
• Authors of publication: Chai, Yun; Wan, Zhi-Long; Guo, Hui-Yuan; Liu, Ming-Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o282
• a: 7.375 ± 0.0014 Å
• b: 10.0132 ± 0.0016 Å
• c: 11.3383 ± 0.0018 Å
• α: 79.571 ± 0.001°
• β: 73.034 ± 0.001°
• γ: 84.973 ± 0.002°
• Cell volume: 787.1 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1013
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1433
• Weighted residual factors for all reflections included in the refinement: 0.1761
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes