Information card for entry 4324775

Structure parameters

• Chemical name: (μ-1,2,4,5-tetrakis(diphenylphosphino)benzene)bis[(1,2- bis(4-methoxyphenyl)ethene-1,2-dithiolato)palladium(II)]
• Formula: C86 H70 O4 P4 Pd2 S4
• Calculated formula: C86 H70 O4 P4 Pd2 S4
• Title of publication: Long-Range Spin Coupling: A Tetraphosphine-Bridged Palladium Dimer
• Authors of publication: Kuppuswamy Arumugam; Mohammed C. Shaw; Joel T. Mague; Eckhard Bill; Stephen Sproules; James P. Donahue
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2995 - 3002
• a: 20.988 ± 0.004 Å
• b: 28.799 ± 0.005 Å
• c: 31.661 ± 0.007 Å
• α: 80.994 ± 0.004°
• β: 76.492 ± 0.002°
• γ: 76.029 ± 0.003°
• Cell volume: 17955 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1434
• Residual factor for significantly intense reflections: 0.078
• Weighted residual factors for significantly intense reflections: 0.1627
• Weighted residual factors for all reflections included in the refinement: 0.1775
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No