Information card for entry 2104221

Structure parameters

• Common name: cyclohexanol
• Chemical name: perdeutero cyclohexanol
• Formula: C6 D12 O
• Calculated formula: C6 D12 O
• Title of publication: Polymorphism in cyclohexanol
• Authors of publication: Ibberson, Richard M.; Parsons, Simon; Allan, David R.; Bell, Anthony M. T.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 5
• Pages of publication: 573 - 582
• a: 10.53507 ± 0.00003 Å
• b: 10.535067 Å
• c: 10.53715 ± 0.00006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1169.49 ± 0.007 ų
• Cell temperature: 2 K
• Number of distinct elements: 3
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Goodness-of-fit parameter for all reflections: 1.15
• Diffraction radiation probe: neutron
• Diffraction radiation type: neutron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No