Information card for entry 8104812

Structure parameters

• Common name: 4-chloro-1-methylpiperidine hydrochloride
• Chemical name: 4-chloro-1-methylpiperidine hydrochloride
• Formula: C6 H13 Cl2 N
• Calculated formula: C6 H13 Cl2 N
• Title of publication: The crystal structure of 4-chloro-1-methylpiperidin-1-ium chloride, C6H13Cl2N
• Authors of publication: Muller, Kina; Hosten, Eric C.; Betz, Richard
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 2
• Pages of publication: 301 - 303
• a: 6.0087 ± 0.0003 Å
• b: 10.1176 ± 0.0006 Å
• c: 14.3532 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 872.58 ± 0.08 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No