Benzo[a]pyrene and Benz[c]phenanthrene: The Effect of Structure on the Binding of Water Molecules to the Diol Epoxides
Author:
Affiliation:
1. United States Environmental Protection Agency, NHEERL/ECD, Research Triangle Park, North Carolina 27711, and Curriculum in Toxicology, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599-7270
Publisher
American Chemical Society (ACS)
Subject
Toxicology,General Medicine
Link
https://pubs.acs.org/doi/pdf/10.1021/tx020009%2B
Reference19 articles.
1. Stereoelectronic factors in the solvolysis of bay region diol epoxides of polycyclic aromatic hydrocarbons
2. Rabinowitz, J., Little, S., and Lewis-Bevan, L. (1996) The effect of crowding in the bay/fjord region on the structure and reactivities of polycyclic aromatic hydrocarbons and their metabolites: quantum mechanical studies.Polycyclic Aromat. Compd.11, 237−244.
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3. Conformations of Benzene- and Dibenzo[a,l]pyrene Diol Epoxides Studied by Density Functional Theory: Ground States, Transition States, Dynamics, and Solvent Effects;Chemical Research in Toxicology;2003-04-12
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