Information card for entry 7038783

Structure parameters

• Formula: C31 H31 B F10 N O2 P
• Calculated formula: C31 H31 B F10 N O2 P
• Title of publication: Nitro-redox reactions at a frustrated borane/phosphane Lewis pair.
• Authors of publication: Chen, Guo-Qiang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6820 - 6823
• a: 12.0754 ± 0.0008 Å
• b: 14.3703 ± 0.0009 Å
• c: 18.9938 ± 0.0013 Å
• α: 77.355 ± 0.004°
• β: 73.434 ± 0.004°
• γ: 85.944 ± 0.004°
• Cell volume: 3082.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0816
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1129
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No