Analysis of bonding motifs in unusual molecules II: infinitene

Author:

Ferreras Katherine N.1ORCID,Harville Taylor1ORCID,Del Angel Cruz Daniel1ORCID,Gordon Mark S.1ORCID

Affiliation:

1. Department of Chemistry and Ames National Laboratory, Iowa State University, Ames, Iowa, 50011, USA

Abstract

The bonding structures of infinitene, the Chemical and Engineering News 2021 Molecule of the Year, is studied by means of oriented quasi-atomic orbitals (QUAOs) to assess the degree of aromaticity within the molecule.

Funder

Iowa State University

Air Force Office of Scientific Research

Chemical Sciences, Geosciences, and Biosciences Division

Publisher

Royal Society of Chemistry (RSC)

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