Information card for entry 7012150

Structure parameters

• Formula: C26 H40 Cl2 O2 P2 Pd2
• Calculated formula: C26 H40 Cl2 O2 P2 Pd2
• SMILES: c12ccc(cc1[P](C(C)C)(C(C)C)[Pd]1([O]2[Pd]2([O]1c1ccc(cc1[P]2(C(C)C)C(C)C)C)Cl)Cl)C
• Title of publication: Synthesis and reactivity of bimetallic palladium(ii) methyl complexes with new functional phosphine ligands
• Authors of publication: Sub Kim, Jang; Sen, Ayusman; Guzei, Ilia A.; Liable-Sands, Louise M.; Rheingold, Arnold L.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 24
• Pages of publication: 4726
• a: 11.078 ± 0.002 Å
• b: 11.83 ± 0.002 Å
• c: 11.619 ± 0.002 Å
• α: 90°
• β: 108.695 ± 0.012°
• γ: 90°
• Cell volume: 1442.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0402
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for all reflections: 0.0884
• Weighted residual factors for significantly intense reflections: 0.0846
• Goodness-of-fit parameter for all reflections: 1.38
• Goodness-of-fit parameter for significantly intense reflections: 1.478
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No