Information card for entry 4065538

Structure parameters

• Formula: C42 H84 Au2 Cl2 P2
• Calculated formula: C42 H84 Au2 Cl2 P2
• Title of publication: Syntheses and Structures of Digold Complexes of Macrobicyclic Dibridgehead Diphosphines That Can Turn Themselves Inside Out
• Authors of publication: Stollenz, Michael; Bhuvanesh, Nattamai; Reibenspies, Joseph H.; Gladysz, John A.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 24
• Pages of publication: 6510
• a: 20.265 ± 0.003 Å
• b: 8.8603 ± 0.0011 Å
• c: 27.301 ± 0.004 Å
• α: 90°
• β: 108.354 ± 0.008°
• γ: 90°
• Cell volume: 4652.6 ± 1.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1122
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.1678
• Weighted residual factors for all reflections included in the refinement: 0.1814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No