Information card for entry 4105756

Structure parameters

• Formula: C15 H32 O2 P2 Pd2
• Calculated formula: C15 H32 O2 P2 Pd2
• SMILES: [Pd]123([Pd]4([P](C)(C)C)([O]=C(O1)CC(=C)C)[C]3(C2)(C4)C)[P](C)(C)C
• Title of publication: Palladium(I)-Bridging Allyl Dimers for the Catalytic Functionalization of CO2
• Authors of publication: Damian P. Hruszkewycz; Jianguo Wu; Nilay Hazari; Christopher D. Incarvito
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 3280 - 3283
• a: 9.659 ± 0.002 Å
• b: 11.105 ± 0.003 Å
• c: 10.452 ± 0.003 Å
• α: 90°
• β: 106.529 ± 0.008°
• γ: 90°
• Cell volume: 1074.8 ± 0.5 ų
• Cell temperature: 223 K
• Ambient diffraction temperature: 223 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0239
• Weighted residual factors for all reflections included in the refinement: 0.0438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No