Information card for entry 7003087

Structure parameters

• Chemical name: trans-bis(diisopropylperfluorovinylphoshine)palladium(II)chloride
• Formula: C16 H28 Cl2 F6 P2 Pd
• Calculated formula: C16 H28 Cl2 F6 P2 Pd
• SMILES: [Pd]([P](C(=C(F)F)F)(C(C)C)C(C)C)([P](C(=C(F)F)F)(C(C)C)C(C)C)(Cl)Cl
• Title of publication: The coordination chemistry of perfluorovinyl substituted phosphine ligands, a crystallographic and spectroscopic study. Co-crystallisation of both cis- and trans-isomers of [PtCl2{PiPr2(CFCF2)}2] within the same unit cell
• Authors of publication: Barnes, Nicholas A.; Brisdon, Alan K.; Brown, F. R. William; Cross, Wendy I.; Herbert, Christopher J.; Pritchard, Robin G.; Sadiq, Ghazala
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 1
• Pages of publication: 101
• a: 8.09 ± 0.002 Å
• b: 8.3232 ± 0.0014 Å
• c: 9.2824 ± 0.0013 Å
• α: 80.593 ± 0.012°
• β: 77.717 ± 0.016°
• γ: 70.897 ± 0.016°
• Cell volume: 574.1 ± 0.2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0567
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1612
• Weighted residual factors for all reflections included in the refinement: 0.209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.229
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No