The photoelectron (PE) spectra of some ortho-disubstituted quinoxalines were measured and assigned mainly on the basis of HAM/3, INDO, and CNDO MO calculations. In the case of cNoro derivatives, the given assignment takes also into account the arguments based on a comparison of HeIUHeI intensities.
The He1 photoelectron (PE) spectra of six 4-substituted 3-methyl-I-phenylpyrdzolin-5-ones and the unsubstituted parent compound were measured. The interpretation of the low-energy region of these spectra is attempted on the basis of HAM/3 molecular orbital calculations, making allowance for different tautomeric forms of the compounds. The results indicate preference of the CH versus the NH and/or OH tautomers of these compounds in the gas phase at the temperatures employed ( 100-1 50°C).
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.