| Literature DB >> 23929506 |
Tomohiro Agou1, Tatsuya Wasano, Peng Jin, Shigeru Nagase, Norihiro Tokitoh.
Abstract
Base free: An alumole was synthesized and treatment with lithium afforded the lithium salt of the alumole dianion. The structures of these two molecules were then investigated. The C-C bond lengths of the AlC4 ring in the dianion are nearly equal. DFT calculations revealed that the 3p(Al)-π* conjugation lowers the LUMO level of the alumole and that coordination of two lithium cations to the alumole dianion results in a planar AlC4 ring.Entities:
Keywords: aluminum; density functional calculations; heterocycles; lithium; structure elucidation
Year: 2013 PMID: 23929506 DOI: 10.1002/anie.201304143
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336