Information card for entry 7703038

Structure parameters

• Formula: C40 H53 B F3 N4 O P
• Calculated formula: C40 H47.637 B F3 N4 O P
• Title of publication: Using frustrated Lewis pairs to explore C-F bond activation.
• Authors of publication: Briceno-Strocchia, Alvaro I; Johnstone, Timothy C.; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 4
• Pages of publication: 1319 - 1324
• a: 10.5556 ± 0.0006 Å
• b: 10.6686 ± 0.0005 Å
• c: 18.9054 ± 0.001 Å
• α: 98.024 ± 0.003°
• β: 90.22 ± 0.003°
• γ: 119.185 ± 0.002°
• Cell volume: 1834.15 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0752
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.132
• Weighted residual factors for all reflections included in the refinement: 0.1455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No