Information card for entry 4125384

Structure parameters

• Formula: C39 H32 B F10 N O3.5
• Calculated formula: C39 H32 B F10 N O3.5
• Title of publication: Reactions of Boron-Derived Radicals with Nucleophiles.
• Authors of publication: Longobardi, Lauren E.; Zatsepin, Pavel; Korol, Roman; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 1
• Pages of publication: 426 - 435
• a: 10.1843 ± 0.001 Å
• b: 12.478 ± 0.0012 Å
• c: 14.2277 ± 0.0013 Å
• α: 96.946 ± 0.006°
• β: 94.317 ± 0.006°
• γ: 113.853 ± 0.005°
• Cell volume: 1626.1 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1292
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No