Information card for entry 4303428

Structure parameters

• Formula: C42 H10 B F15 P S2
• Calculated formula: C42 H10 B F15 P S2
• Title of publication: Heterolytic Cleavage of Disulfides by Frustrated Lewis Pairs
• Authors of publication: Meghan A. Dureen; Gregory C. Welch; Thomas M. Gilbert; Douglas W. Stephan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 9910 - 9917
• a: 17.1871 ± 0.0008 Å
• b: 20.1089 ± 0.001 Å
• c: 23.865 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8248.1 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1056
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.1767
• Weighted residual factors for all reflections included in the refinement: 0.1971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No