Information card for entry 2201180

Structure parameters

• Formula: C5 H12 Cl N O
• Calculated formula: C5 H12 Cl N O
• SMILES: [Cl-].O[NH+]1CCCCC1
• Title of publication: <i>N</i>-Hydroxypiperidinium chloride
• Authors of publication: Wolfgang Kliegel; Ulf Riebe; Brian O. Patrick; Steven J. Rettig; James Trotter
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 5
• Pages of publication: o509 - o510
• a: 7.1304 ± 0.0005 Å
• b: 7.0213 ± 0.0005 Å
• c: 14.4857 ± 0.0009 Å
• α: 90°
• β: 93.333 ± 0.004°
• γ: 90°
• Cell volume: 724 ± 0.09 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.047
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for all reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections: 1.625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.625
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes