Information card for entry 7133427

Structure parameters

• Formula: C29 H53.5 Au B Cl N2 O0.75 P
• Calculated formula: C29 H53.5 Au B Cl N2 O0.75 P
• Title of publication: 2-Alkylphosphino-1-boraadamantanes.
• Authors of publication: Hoffmann, Kurt F.; Noriega, Rayni P.; Boyle, Paul D.; Drover, Marcus W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 69
• Pages of publication: 9222 - 9225
• a: 7.1927 ± 0.0004 Å
• b: 11.9175 ± 0.0006 Å
• c: 19.131 ± 0.001 Å
• α: 78.6195 ± 0.0018°
• β: 86.0612 ± 0.0018°
• γ: 86.5573 ± 0.0018°
• Cell volume: 1602.04 ± 0.15 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No