Information card for entry 2207721

Structure parameters

• Chemical name: 3-Azaspiro[5.5]undecane-2,4-dione
• Formula: C10 H15 N O2
• Calculated formula: C10 H15 N O2
• SMILES: O=C1NC(=O)CC2(C1)CCCCC2
• Title of publication: 3-Azaspiro[5.5]undecane-2,4-dione
• Authors of publication: Xiu-Rong Hu; Wei-Ming Xu; Jian-Ming Gu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: o264 - o265
• a: 11.402 ± 0.007 Å
• b: 6.231 ± 0.003 Å
• c: 13.942 ± 0.005 Å
• α: 90°
• β: 107.324 ± 0.018°
• γ: 90°
• Cell volume: 945.6 ± 0.8 ų
• Cell temperature: 296 ± 1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes