Information card for entry 4313477

Structure parameters

• Formula: C66 H68 Au2 Cl2 P2 S4
• Calculated formula: C62.514 H60 Au2 Cl2 P2 S4
• Title of publication: Model Complexes for Metallated Polythiophenes: Gold(I) and Palladium(II) Complexes of Bis(diphenylphosphino)oligothiophenes
• Authors of publication: Olivier Clot; Yumi Akahori; Carolyn Moorlag; Daniel B. Leznoff; Michael O. Wolf; Raymond J. Batchelor; Brian O. Patrick; Mikita Ishii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2704 - 2713
• a: 11.1656 ± 0.0006 Å
• b: 19.05 ± 0.001 Å
• c: 29.732 ± 0.003 Å
• α: 90°
• β: 91.199 ± 0.002°
• γ: 90°
• Cell volume: 6322.8 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1172
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 0.759
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No