Information card for entry 4021221

Structure parameters

• Formula: C36 H32 Cl2 N O2 P Pd
• Calculated formula: C36 H32 Cl2 N O2 P Pd
• SMILES: [Pd]1(Cl)(Cl)[P](c2c([C@H]3OC([C@H]4[N]13C[C@@H](O)C4)(c1ccccc1)c1ccccc1)cccc2)(c1ccccc1)c1ccccc1
• Title of publication: Chiral Phosphinooxazolidine Ligands for Palladium- and Platinum-Catalyzed Asymmetric Diels-Alder Reactions
• Authors of publication: Hiroto Nakano; Kouichi Takahashi; Yuko Okuyama; Chieko Senoo; Natsumi Tsugawa; Yuichiro Suzuki; Reiko Fujita; Kazuo Sasaki; Chizuko Kabuto
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 7092 - 7100
• a: 12.259 ± 0.003 Å
• b: 10.597 ± 0.002 Å
• c: 12.465 ± 0.003 Å
• α: 90°
• β: 93.697 ± 0.001°
• γ: 90°
• Cell volume: 1615.9 ± 0.6 ų
• Cell temperature: 173.1 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No