Information card for entry 4313472

Structure parameters

• Formula: C52 H52 Cl2 P2 Pd S4
• Calculated formula: C52 H50.36 Cl2 P2 Pd 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: 13.6973 ± 0.0008 Å
• b: 13.7726 ± 0.0009 Å
• c: 14.2939 ± 0.0008 Å
• α: 73.154 ± 0.008°
• β: 76.805 ± 0.009°
• γ: 73.74 ± 0.009°
• Cell volume: 2445.6 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0815
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No