| Literature DB >> 25753949 |
Abstract
We have studied uthrene with a large range of quantum chemical models. Uthrene is predicted to be naturally twisted and to possess a triplet ground state, making it the smallest non-planar polycyclic biradical that can be derived from graphene.Entities:
Year: 2015 PMID： 25753949 DOI： 10.1039/c5cc01276g
Source DB: PubMed Journal: Chem Commun (Camb) ISSN： 1359-7345 Impact factor: 6.222