Information card for entry 7121659

Structure parameters

• Formula: C34.67 H25.33 B0.67 Br0.67 F10 O1.33 P0.67
• Calculated formula: C34.6667 H25.3333 B0.666667 Br0.666667 F10 O1.33333 P0.666667
• Title of publication: Homolytic cleavage of peroxide bonds via a single electron transfer of a frustrated Lewis pair.
• Authors of publication: Liu, Liu Leo; Cao, Levy L.; Zhu, Diya; Zhou, Jiliang; Stephan, Douglas W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 54
• Pages of publication: 7431 - 7434
• a: 12.6688 ± 0.0009 Å
• b: 18.7187 ± 0.0014 Å
• c: 20.0531 ± 0.0014 Å
• α: 90.811 ± 0.003°
• β: 91.169 ± 0.003°
• γ: 97.947 ± 0.003°
• Cell volume: 4708.1 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1699
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1348
• Weighted residual factors for all reflections included in the refinement: 0.1642
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No