Information card for entry 7012866

Structure parameters

• Formula: C79 H76 Cl6 N2 O4 P4 Pd3 S2
• Calculated formula: C79 H76 Cl6 N2 O4 P4 Pd3 S2
• Title of publication: Synthesis and structural characterisation of the palladium cluster compounds [Pd3(μ-SO2)2(μ-PPh2py)2(PBz3)2] and [Pd4(μ-SO2)2(μ3-S)(CNR)(PBz3)4] (R =tBu, 2,6-dimethylphenyl and cyclohexyl)
• Authors of publication: Anna M. Williamson; Gareth R. Owen; D. Michael P. Mingos; Ramón Vilar; Andrew J. P. White; David J. Williams
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 2526 - 2532
• a: 13.9578 ± 0.0011 Å
• b: 14.475 ± 0.0012 Å
• c: 20.1575 ± 0.0015 Å
• α: 95.19 ± 0.009°
• β: 100.051 ± 0.008°
• γ: 97.313 ± 0.007°
• Cell volume: 3950.9 ± 0.6 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0728
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections: 0.1424
• Weighted residual factors for significantly intense reflections: 0.1235
• Goodness-of-fit parameter for all reflections: 1.036
• Goodness-of-fit parameter for significantly intense reflections: 1.065
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No