Information card for entry 4061202

Structure parameters

• Formula: C39 H43 F6 O P2 Pd Sb
• Calculated formula: C39 H41 F6 O P2 Pd Sb
• SMILES: [Pd]123([P](CCC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[C@@H]1[C@@H](OCC)[C@H]4C[C@@H]1[C@@H]1[C@H]4C[CH]2=[CH]31.[Sb](F)(F)(F)(F)(F)[F-].[Pd]123([P](CCC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[C@H]1[C@H](OCC)[C@@H]4C[C@H]1[C@H]1[C@@H]4C[CH]2=[CH]31.[Sb](F)(F)(F)(F)(F)[F-]
• Title of publication: Novel Single-Component Palladium(II) Catalysts for the Alternating CO/Propene Copolymerization Reaction
• Authors of publication: Meinhard, Dieter; Hollmann, Frank; Huhn, Wolfgang; Thewalt, Ulf; Klinga, Marttii; Rieger, Bernhard
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 23
• Pages of publication: 5637 - 5639
• a: 19.735 ± 0.004 Å
• b: 12.5439 ± 0.0016 Å
• c: 15.9509 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3948.7 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No