Information card for entry 2213171

Structure parameters

• Chemical name: cis-(Piperidine-2,6-diyl)dimethanol
• Formula: C7 H15 N O2
• Calculated formula: C7 H15 N O2
• SMILES: [C@@H]1(N[C@H](CCC1)CO)CO
• Title of publication: <i>cis</i>-(Piperidine-2,6-diyl)dimethanol
• Authors of publication: Hartung, Jens; Stapf, Georg; Bergsträsser, Uwe
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: o2586 - o2587
• a: 9.555 ± 0.003 Å
• b: 8.512 ± 0.0019 Å
• c: 9.906 ± 0.002 Å
• α: 90°
• β: 94.95 ± 0.02°
• γ: 90°
• Cell volume: 802.7 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0306
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes