| Literature DB >> 17854194 |
Chun-Shan Zuo1, Jun-Min Quan, Yun-Dong Wu.
Abstract
Density functional theory calculations indicate that the cage molecule 4 can trap F- in the gas phase (-80.5 kcal/mol) as well as in CH2Cl2 (-14.7 kcal/mol) via strong C-H...F- hydrogen bonds and pi...F- interaction.Entities:
Mesh:
Substances:
Year: 2007 PMID: 17854194 DOI: 10.1021/ol701740p
Source DB: PubMed Journal: Org Lett ISSN: 1523-7052 Impact factor: 6.005