Information card for entry 7037045

Structure parameters

• Formula: C20 H3 B Cl10 F6
• Calculated formula: C20 H3 B Cl10 F6
• Title of publication: Novel B(Ar')2(Ar'') hetero-tri(aryl)boranes: a systematic study of Lewis acidity.
• Authors of publication: Blagg, Robin J.; Simmons, Trevor R.; Hatton, Georgina R.; Courtney, James M.; Bennett, Elliot L.; Lawrence, Elliot J.; Wildgoose, Gregory G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6032 - 6043
• a: 8.5532 ± 0.0017 Å
• b: 9.742 ± 0.002 Å
• c: 30.812 ± 0.008 Å
• α: 90°
• β: 90.871 ± 0.018°
• γ: 90°
• Cell volume: 2567.1 ± 1 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2819
• Residual factor for significantly intense reflections: 0.0891
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.2313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No