Abstract
New palladium acetate complexes, Pd2(OOCMe) +4 , Pd2(OOCMe) +3 , Pd2(OOCMe) +2 , and Pd2(OOCMe)+ were detected in the thermal decomposition products of trans-Pd(Py)2(OOCMe)2 by mass spectrometry with direct ion source. The geometric and electronic structures of the Pd2(μ-OOCMe) +4 cation and the Pd2(OOCMe)4 molecule were established by quantum chemical calculations (DFT with the PBE1PBE hybrid exchange correlation potential in the 6-31G*/SDD basis set) and natural orbital analysis.
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Original Russian Text © I.Ya. Yakushev, A.E. Gekhman, A.P. Klyagina, A.A. Markov, M.N. Vargaftik, I.P. Stolyarov, N.V. Cherkashina, A.B. Kornev, I.I. Moiseev, 2016, published in Koordinatsionnaya Khimiya, 2016, Vol. 42, No. 9, pp. 563–566.
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Yakushev, I.Y., Gekhman, A.E., Klyagina, A.P. et al. Palladium acetate complexes in the gas phase. Russ J Coord Chem 42, 604–607 (2016). https://doi.org/10.1134/S1070328416090098
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DOI: https://doi.org/10.1134/S1070328416090098