Information card for entry 4109943

Structure parameters

• Common name: Platinum/Palladium Carbonyl Phosphine cluster
• Formula: C450 H336 O78 P20 Pd157.2 Pt7.8
• Calculated formula: C468 O84 P20 Pd157.16 Pt7.84
• Title of publication: Nanosized (μ12-Pt)Pd164-xPtx(CO)72(PPh3)20 (x ~ 7) Containing Pt-Centered Four-Shell 165-Atom Pd-Pt Core with Unprecedented Intershell Bridging Carbonyl Ligands: Comparative Analysis of Icosahedral Shell-Growth Patterns with Geometrically Related Pd145(CO)x(PEt3)30 (x ~ 60) Containing Capped Three-Shell Pd145 Core
• Authors of publication: Evgueni G. Mednikov; Matthew C. Jewell; Lawrence F. Dahl
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 11619 - 11630
• a: 32.8615 ± 0.0008 Å
• b: 32.8615 ± 0.0008 Å
• c: 32.8615 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 35486.4 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 204
• Hermann-Mauguin space group symbol: I m -3
• Hall space group symbol: -I 2 2 3
• Residual factor for all reflections: 0.1671
• Residual factor for significantly intense reflections: 0.1112
• Weighted residual factors for significantly intense reflections: 0.3026
• Weighted residual factors for all reflections included in the refinement: 0.3553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.374
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No