Information card for entry 7009626

Structure parameters

• Formula: C30 H31 F3 N2 O5 P2 Pd S
• Calculated formula: C30 H31 F3 N2 O5 P2 Pd S
• Title of publication: Coordination properties of novel hemilabile acetamide-derived P,O phosphine ligands. Crystal structures of Ph2PNHC(O)Me and [PdMe{PPh2NHC(O)Me}{PPh2NHC(O)Me}][O3SCF3] †
• Authors of publication: Braunstein, Pierre; Frison, Céline; Morise, Xavier; Adams, Richard D.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 2205
• a: 9.542 ± 0.001 Å
• b: 15.538 ± 0.004 Å
• c: 22.717 ± 0.003 Å
• α: 90°
• β: 92.21 ± 0.01°
• γ: 90°
• Cell volume: 3365.6 ± 1 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for all reflections: 0.0511
• Weighted residual factors for all reflections included in the refinement: 0.0511
• Goodness-of-fit parameter for all reflections: 1.327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.327
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No