Information card for entry 4346466

Structure parameters

• Formula: C55 H52 Cl6 O4 P2 Pd2 S4
• Calculated formula: C54.5 H52 Cl6 O4 P2 Pd2 S4
• Title of publication: Phosphine control of the oxidative addition chemistry of tetrathiocins to palladium(0): characterization of mono-, di-, and hexanuclear palladium(II) dithiolate complexes.
• Authors of publication: Wrixon, Justin D.; Hayward, John J.; Rawson, Jeremy M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 19
• Pages of publication: 9384 - 9386
• a: 16.9591 ± 0.0017 Å
• b: 20.351 ± 0.002 Å
• c: 8.4374 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2912 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0201
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections included in the refinement: 0.0491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No