Articles with "nics scan" as a keyword



Is (benzene)Cr(CO)3 really more aromatic than benzene

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Published in 2017 at "Canadian Journal of Chemistry"

DOI: 10.1139/cjc-2016-0334

Abstract: (benzene)Cr(CO)3 was claimed to be more aromatic than benzene, based on the central 1H Me chemical shifts in dimethyldihydropyrene annulated to it. In this paper, several dihydropyrenes are computationally investigated. NICS-scan methods are used to… read more here.

Keywords: annulated dihydropyrenes; ring currents; benzene; benzene really ... See more keywords