Information card for entry 2219794

Structure parameters

• Chemical name: <i>tert</i>-Butyl <i>N</i>-(4-methyl-2-pyridyl)carbamate
• Formula: C11 H16 N2 O2
• Calculated formula: C11 H16 N2 O2
• SMILES: c1(nccc(c1)C)NC(=O)OC(C)(C)C
• Title of publication: <i>tert</i>-Butyl <i>N</i>-(4-methyl-2-pyridyl)carbamate
• Authors of publication: Koch, Pierre; Schollmeyer, Dieter; Laufer, Stefan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: o2216
• a: 10.585 ± 0.0006 Å
• b: 11.6854 ± 0.0006 Å
• c: 18.5568 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2295.3 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.132
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes