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Mass spectrometric method of analysis of aromatic hydrocarbons and sulfur compounds

✍ Scribed by E. S. Brodskii; R. A. Khmel'nitskii; A. A. Polyakova; I. M. Lukashenko


Publisher
Springer US
Year
1972
Tongue
English
Weight
282 KB
Volume
8
Category
Article
ISSN
0009-3092

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## Abstract Proton affinities (PAs) in the gas phase have been calculated for a series of polynuclear aromatic hydrocarbons by MOPAC 6.0 using AM1 and PM3 Hamiltonians and compared to the experimental values published in the literature. A correlation between PAs and the reactional competition leadi