Information card for entry 2008961

Structure parameters

• Chemical name: 2,2,6,6-tetramethyl-4-(methylsulfonyl-oxyl)-1-piperidinooxy
• Formula: C10 H20 N O4 S
• Calculated formula: C10 H20 N O4 S
• SMILES: S(=O)(=O)(OC1CC(N([O])C(C1)(C)C)(C)C)C
• Title of publication: 2,2,6,6-Tetramethyl-4-(methylsulfonyloxy)piperidinyl 1-oxide
• Authors of publication: Homrighausen, Craig L.; Krause Bauer, Jeanette A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 9
• Pages of publication: IUC9900102
• a: 12.951 ± 0.003 Å
• b: 9.977 ± 0.002 Å
• c: 11.131 ± 0.002 Å
• α: 90°
• β: 113.52 ± 0.03°
• γ: 90°
• Cell volume: 1318.8 ± 0.6 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.091
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes