Information card for entry 7126164

Structure parameters

• Formula: C61 H88 Au B2 K O7 P2
• Calculated formula: C61 H88 Au B2 K O7 P2
• Title of publication: C[double bond, length as m-dash]O scission and reductive coupling of organic carbonyls by a redox-active diboraanthracene.
• Authors of publication: Taylor, Jordan W.; Harman, W. Hill
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 32
• Pages of publication: 4480 - 4483
• a: 11.3469 ± 0.0011 Å
• b: 13.0442 ± 0.0013 Å
• c: 21.464 ± 0.002 Å
• α: 103.942 ± 0.0014°
• β: 95.7811 ± 0.0014°
• γ: 101.004 ± 0.0015°
• Cell volume: 2990.5 ± 0.5 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: 0.0715
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1149
• Weighted residual factors for all reflections included in the refinement: 0.1245
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No