Information card for entry 4103323

Structure parameters

• Common name: Pd-complex acetate
• Chemical name: Pd-complex acetate, acetone
• Formula: C27.775 H28.55 N3 O5.925 Pd
• Calculated formula: C25 H23 N3 O5 Pd
• Title of publication: Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)
• Authors of publication: Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 14400 - 14402
• a: 13.097 ± 0.0016 Å
• b: 17.566 ± 0.002 Å
• c: 13.4039 ± 0.0016 Å
• α: 90°
• β: 107.34 ± 0.002°
• γ: 90°
• Cell volume: 2943.6 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.0404
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0783
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No