Information card for entry 2220324

Structure parameters

• Chemical name: <i>tert</i>-Butyl 4-carbamoyl-3-methoxyimino-4-methylpiperidine-1-carboxylate
• Formula: C13 H23 N3 O4
• Calculated formula: C13 H23 N3 O4
• SMILES: N1(CC(=NOC)C(CC1)(C(=O)N)C)C(=O)OC(C)(C)C
• Title of publication: <i>tert</i>-Butyl 4-carbamoyl-3-methoxyimino-4-methylpiperidine-1-carboxylate
• Authors of publication: Wang, Juxian; Liu, Mingliang; Cao, Jue; Wang, Yucheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2294
• a: 22.813 ± 0.002 Å
• b: 22.813 ± 0.002 Å
• c: 12.0742 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6283.8 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.1004
• Weighted residual factors for all reflections included in the refinement: 0.1128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes