Information card for entry 4342913

Structure parameters

• Chemical name: cis-Dichloro- bis(trimetylphosphine)palladium (II)
• Formula: C7 H19 Cl5 P2 Pd
• Calculated formula: C7 H19 Cl5 P2 Pd
• Title of publication: Nanosized {Pd4(μ4-C)}Pd32(CO)28(PMe3)14 Containing Tetrahedrally Deformed Pd4 Cage with Encapsulated Carbide Atom: Formal Substitution of Geometrically Analogous Interior Au4 Entity in Isostructural Au4Pd32(CO)28(PMe3)14 by Electronically Equivalent Pd4(μ4-C) and Computational/Catalytic Implications.
• Authors of publication: Mednikov, Evgueni G.; Ivanov, Sergei A.; Dahl, Lawrence F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 6157 - 6168
• a: 10.1667 ± 0.0007 Å
• b: 28.1052 ± 0.0019 Å
• c: 11.6394 ± 0.0008 Å
• α: 90°
• β: 90.322 ± 0.001°
• γ: 90°
• Cell volume: 3325.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0353
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0873
• Weighted residual factors for all reflections included in the refinement: 0.0885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No