Information card for entry 4075662

Structure parameters

• Formula: C33 H31 Cl2 N P2 Pd
• Calculated formula: C33 H31 Cl2 N P2 Pd
• SMILES: [Pd]1(Cl)(Cl)[N]([C@H](C)c2ccccc2)=P(C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of New Mixed Phosphineσim Iminophosphorane Bidentate Ligands and Their Coordination to Group 10 Metal Centers
• Authors of publication: Boubekeur, Leïla; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 6
• Pages of publication: 1065
• a: 12.335 ± 0.001 Å
• b: 13.648 ± 0.001 Å
• c: 17.643 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2970.2 ± 0.4 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No