Information card for entry 4088484

Structure parameters

• Common name: Biphenyl BP cluster
• Formula: C54 H51 B P
• Calculated formula: C54 H51 B P
• Title of publication: Reactivity of a Phosphaalkyne with Pentaarylboroles
• Authors of publication: Barnard, Jonathan H.; Yruegas, Sam; Couchman, Shannon A.; Wilson, David J. D.; Dutton, Jason L.; Martin, Caleb D.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 7
• Pages of publication: 929
• a: 11.3812 ± 0.0008 Å
• b: 12.7207 ± 0.0009 Å
• c: 15.9938 ± 0.0012 Å
• α: 95.795 ± 0.002°
• β: 107.259 ± 0.002°
• γ: 107.969 ± 0.002°
• Cell volume: 2055.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.06
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No