Information card for entry 4125583

Structure parameters

• Formula: C32 H45 B2 F O6
• Calculated formula: C32 H45 B2 F O6
• Title of publication: Benzyltriboronates: Building Blocks for Diastereoselective Carbon-Carbon Bond Formation.
• Authors of publication: Palmer, W. Neil; Zarate, Cayetana; Chirik, Paul J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 7
• Pages of publication: 2589 - 2592
• a: 38.3946 ± 0.0017 Å
• b: 10.3577 ± 0.0004 Å
• c: 17.4348 ± 0.0007 Å
• α: 90°
• β: 115.662 ± 0.002°
• γ: 90°
• Cell volume: 6249.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.1249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No