Information card for entry 4305110

Structure parameters

• Formula: C37 H50 Cl11 Li O6 P4 Pd2
• Calculated formula: C37 H50 Cl11 Li O6 P4 Pd2
• SMILES: c1(ccccc1)[P]1(c2ccccc2)CP(=[O][Li]34[O]=P(C[P](c2ccccc2)(c2ccccc2)[Pd]([Cl][Pd]1(Cl)[Cl]3)(Cl)[Cl]4)(OCC)OCC)(OCC)OCC.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: Lithium-Palladium Complex Supported by Phosphonatophosphine and Chloride Ligands
• Authors of publication: Adel Hamada; Pierre Braunstein
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 3934 - 3936
• a: 11.1497 ± 0.0005 Å
• b: 15.5662 ± 0.0006 Å
• c: 16.6267 ± 0.0008 Å
• α: 110.906 ± 0.002°
• β: 95.971 ± 0.002°
• γ: 91.575 ± 0.002°
• Cell volume: 2674.6 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0812
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.1036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No