Information card for entry 7015827

Structure parameters

• Formula: C22 H51 Cl2 N3 P2 Pd
• Calculated formula: C22 H51 Cl2 N3 P2 Pd
• SMILES: [Pd]12(Cl)[N](=P(C(C)C)(C(C)C)C(C)C)CC[NH]2CC[N]1=P(C(C)C)(C(C)C)C(C)C.[Cl-]
• Title of publication: Mononuclear and dinuclear palladium and nickel complexes of phosphinimine-based tridentate ligands.
• Authors of publication: Cariou, Renan; Dahcheh, Fatme; Graham, Todd W.; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 18
• Pages of publication: 4918 - 4925
• a: 8.6503 ± 0.0002 Å
• b: 26.8756 ± 0.0005 Å
• c: 12.088 ± 0.0003 Å
• α: 90°
• β: 93.156 ± 0.001°
• γ: 90°
• Cell volume: 2805.98 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0471
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No