Information card for entry 5910115

Structure parameters

• Chemical name: Ethanol
• Formula: C2 H6 O
• Calculated formula: C2 H6 O
• Title of publication: Hydrogen bond studies. CXIII. The crystal structure of ethanol at 87 K
• Authors of publication: P.-G. Jönsson
• Journal of publication: Acta Crystallogr.,Sect.B:Struct.Crystallogr.Cryst.Chem.
• Year of publication: 1976
• Journal volume: 32
• Pages of publication: 232 - 235
• a: 5.377 ± 0.004 Å
• b: 6.882 ± 0.005 Å
• c: 8.255 ± 0.008 Å
• α: 90°
• β: 102.2 ± 0.1°
• γ: 90°
• Cell volume: 298.6 ± 0.4 ų
• Ambient diffraction temperature: 87 K
• Number of distinct elements: 3
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.028
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No