Information card for entry 4323641

Structure parameters

• Formula: C63 H94 Au2 Cl N O4 P3
• Calculated formula: C63 H84 Au2 Cl N O4 P3
• Title of publication: Restricted Rotation around the P-C Bond in Metalated Phosphonium Salts: A Variable-Temperature 1H NMR Study. X-ray Crystal Structures of [{AuP(C6H11)3}2{μ-C(PTo3)(py-2)}]ClO4 and [(AuPPh3)2{μ-{C(PPh3)(py-2)}(AuPPh3)}](CF3SO3)2
• Authors of publication: José Vicente; María-Teresa Chicote; María-Cristina Lagunas; Peter G. Jones; Birte Ahrens
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 4938 - 4944
• a: 14.056 ± 0.003 Å
• b: 24.556 ± 0.004 Å
• c: 19.11 ± 0.003 Å
• α: 90°
• β: 111 ± 0.02°
• γ: 90°
• Cell volume: 6158 ± 2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.065
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for all reflections: 0.0943
• Weighted residual factors for significantly intense reflections: 0.0789
• Goodness-of-fit parameter for all reflections: 1.065
• Goodness-of-fit parameter for significantly intense reflections: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No