Information card for entry 4075799

Structure parameters

• Chemical name: (μ~2~-bromo)bis((η^3^-allyl)(trimethylphosphine)palladium) tetra(pentafluorophenyl)borate
• Formula: C54 H64 B Br F20 P2 Pd2
• Calculated formula: C54 H63 B Br F20 P2 Pd2
• Title of publication: Dinuclear [{(π-C3H5)M(PR3)}2(μ-X)]Y Complexes of Nickel and Palladium†
• Authors of publication: Alberti, Davide; Goddard, Richard; Pörschke, Klaus-Richard
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 16
• Pages of publication: 3907
• a: 14.8137 ± 0.0001 Å
• b: 22.6355 ± 0.0001 Å
• c: 17.6457 ± 0.0001 Å
• α: 90°
• β: 103.995 ± 0.0003°
• γ: 90°
• Cell volume: 5741.24 ± 0.06 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.0571
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No