Information card for entry 4075664

Structure parameters

• Formula: C31 H27 Cl2 N P2 Pd
• Calculated formula: C31 H27 Cl2 N P2 Pd
• SMILES: [Pd]1(Cl)(Cl)[P](c2ccccc2)(c2ccccc2)CP(=[N]1c1ccccc1)(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: 11.36 ± 0.001 Å
• b: 14.822 ± 0.001 Å
• c: 17.095 ± 0.001 Å
• α: 90°
• β: 105.17 ± 0.001°
• γ: 90°
• Cell volume: 2778.1 ± 0.3 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0489
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No