Absolute proton affinities of some subst
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Mirjana Eckert-MaksiΔ; Andrea KneΕΎeviΔ; Zvonimir B. MaksiΔ
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Article
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1998
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John Wiley and Sons
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English
β 134 KB
The problem of the ipso protonation of toluene and its predominantly disubstituted derivatives was considered by the MP2(fc)/6-31G \*\* //HF/6-31G \* ZPE(HF/6-31G \* ) theoretical model. The substituents involved covered a wide range of different donor-acceptor capabilities. It is shown that the cal