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Published in 2020 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2019.136860
Abstract: Abstract An explorative quantum chemical study of the boron-nitrogen (BN) analogues of cyclo[18]carbon (C18) is performed. The molecular geometries of nineteen BN analogues were optimized and their relative stability, normal modes of vibration, frontier orbitals,…
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Keywords:
cyclo carbon;
boron nitrogen;
nitrogen analogues;
analogues cyclo ... See more keywords