Information card for entry 2000893

Structure parameters

• Formula: C11 H21 F O3 S
• Calculated formula: C11 H22 F2 O3 S
• Title of publication: Bond length and reactivity. The effect of β-fluorine. Structures of the 4-phenylbenzoate and methanesulfonate esters of <i>trans</i>,<i>cis</i>-4-<i>tert</i>-butyl-2-fluorocyclohexanol
• Authors of publication: Jones, P. G.; Kirby, A. J.; Parker, J. K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 5
• Pages of publication: 855 - 858
• a: 17.09 ± 0.004 Å
• b: 7.678 ± 0.002 Å
• c: 10.806 ± 0.003 Å
• α: 90°
• β: 106.54 ± 0.02°
• γ: 90°
• Cell volume: 1359.3 ± 0.6 ų
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No