Information card for entry 7213229

Structure parameters

• Chemical name: trans-1,4-bis(Z-pentafluoroprop-2-enyl)cyclohexane
• Formula: C12 H10 F10
• Calculated formula: C12 H10 F10
• Title of publication: Free radical chemistry. Part 10. Addition of acyclic and cyclic alkanes to hexafluoropropene
• Authors of publication: Chambers, Richard D.; Fuss, Robert W.; Spink, Robert C. H.; Greenhall, Martin P.; Kenwright, Alan M.; Batsanov, Andrei S.; Howard, Judith A. K.
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 2000
• Journal issue: 10
• Pages of publication: 1623
• a: 15.006 ± 0.013 Å
• b: 7.217 ± 0.004 Å
• c: 6.223 ± 0.005 Å
• α: 90°
• β: 102.74 ± 0.07°
• γ: 90°
• Cell volume: 657.3 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0575
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for all reflections: 0.1142
• Weighted residual factors for significantly intense reflections: 0.1084
• Goodness-of-fit parameter for all reflections: 1.069
• Goodness-of-fit parameter for significantly intense reflections: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No