Information card for entry 2100005

Structure parameters

• Common name: 4-piperidinic acid
• Chemical name: piperidine-4-carboxylic acid
• Formula: C6 H11 N O2
• Calculated formula: C6 H11 N O2
• SMILES: C(=O)(C1CC[NH2+]CC1)[O-]
• Title of publication: Temperature effects on the hydrogen-bond patterns in 4-piperidinecarboxylic acid
• Authors of publication: Asiloé J. Mora; Edward E. Ávila; Gerzon E. Delgado; Andrew N. Fitch; Michella Brunelli
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: 96 - 102
• a: 10.8548 ± 0.0002 Å
• b: 9.752 ± 0.0001 Å
• c: 6.1152 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 647.331 ± 0.017 ų
• Cell temperature: 363 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n 21 a
• Hall space group symbol: P -2ac -2n
• Goodness-of-fit parameter for all reflections: 2.37
• Diffraction radiation wavelength: 0.334971 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes