Information card for entry 4068375

Structure parameters

• Formula: C34 H10 B2 F20 O2
• Calculated formula: C34 H10 B2 F20 O2
• SMILES: Fc1c2c(c(F)c(F)c1F)[B](OB2c1c(F)c(F)c(F)c(F)c1c1c(F)c(F)c(F)c(F)c1)([O]1CCCC1)c1c(F)c(F)c(F)c(F)c1c1c(F)c(F)c(F)c(F)c1
• Title of publication: Isobutene Polymerization Using Chelating Diboranes: Polymerization in Aqueous Suspension and Hydrocarbon Solution
• Authors of publication: Lewis, Stewart P.; Chai, Jianfang; Collins, Scott; Sciarone, Timo J. J.; Henderson, Lee D.; Fan, Cheng; Parvez, Masood; Piers, Warren E.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 249
• a: 9.641 ± 0.002 Å
• b: 10.631 ± 0.004 Å
• c: 15.391 ± 0.005 Å
• α: 92.591 ± 0.014°
• β: 94.331 ± 0.019°
• γ: 92.415 ± 0.018°
• Cell volume: 1569.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.1307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No