Information card for entry 4105752

Structure parameters

• Formula: C18 H40 P2 Pd2
• Calculated formula: C18 H40 P2 Pd2
• SMILES: [Pd]1234([Pd]56([P](CC)(CC)CC)([CH]4(C1)C5)C[CH]36C2)[P](CC)(CC)CC
• 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: 13.218 ± 0.002 Å
• b: 10.4537 ± 0.0016 Å
• c: 17.73 ± 0.003 Å
• α: 90°
• β: 110.013 ± 0.003°
• γ: 90°
• Cell volume: 2301.9 ± 0.6 ų
• Cell temperature: 223.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No