Information card for entry 7153883

Structure parameters

• Chemical name: 4-tert-Butoxycarbonylamino-2,2,6,6-tetramethylpiperidin-1-oxid
• Formula: C14 H27 N2 O3
• Calculated formula: C14 H27 N2 O3
• SMILES: C1(CC(NC(=O)OC(C)(C)C)CC([N]1=O)(C)C)(C)C
• Title of publication: Synthesis, physicochemical properties and antimicrobial activity of mono-/dinitroxyl amides.
• Authors of publication: Kavala, Miroslav; Brezová, Vlasta; Svorc, Lubomír; Vihonská, Zuzana; Olejníková, Petra; Moncol, Ján; Kožíšek, Jozef; Herich, Peter; Szolcsányi, Peter
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2014
• Journal volume: 12
• Journal issue: 25
• Pages of publication: 4491 - 4502
• a: 11.94158 ± 0.00018 Å
• b: 12.0243 ± 0.0002 Å
• c: 11.31901 ± 0.00019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1625.29 ± 0.05 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1661
• Weighted residual factors for all reflections included in the refinement: 0.1727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No