Information card for entry 4100990

Structure parameters

• Formula: C26 H40 Cl N2 P Pd
• Calculated formula: C26 H40 Cl N2 P Pd
• SMILES: [Pd]1(Cl)([P](C(C)(C)C)(C(C)(C)C)C[C@H](C#N)C)[N]([C@@H](c2c1ccc1c2cccc1)C)(C)C
• Title of publication: 3H-Benzophosphepine Complexes: Versatile Phosphinidene Precursors
• Authors of publication: Borst, Mark L. G.; Bulo, Rosa E.; Gibney, Daniele J.; Alem, Yonathan; de Kanter, Franciscus J. J.; Ehlers, Andreas W.; Schakel, Marius; Lutz, Martin; Spek, Anthony L.; Lammertsma, Koop
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 8.9815 ± 0.0006 Å
• b: 15.1441 ± 0.0011 Å
• c: 19.2553 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2619 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No