Information card for entry 2202148

Structure parameters

• Chemical name: 2-Hydroxycyclohexene-1-carboxylic acid
• Formula: C7 H10 O3
• Calculated formula: C7 H10 O3
• Title of publication: 2-Hydroxycyclohexene-1-carboxylic acid: the enol isomer of 2-oxocyclohexane-1-carboxylic acid
• Authors of publication: Kresge, A. Jerry; Lough, Alan J.; Zhu, Yu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 3
• Pages of publication: o344 - o346
• a: 11.136 ± 0.0004 Å
• b: 11.1049 ± 0.0003 Å
• c: 22.8774 ± 0.0009 Å
• α: 90°
• β: 91.9072 ± 0.0012°
• γ: 90°
• Cell volume: 2827.55 ± 0.17 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 3
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1184
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes