Exploring the reducing role of boron: added insights from theory
Author:
Affiliation:
1. Physical Chemistry Division
2. CSIR-National Chemical Laboratory
3. Pune 411008
4. India
Abstract
Why are boron containing systems so effective at CO coupling? Full quantum chemical calculations with density functional theory (DFT) provide interesting insights into why recently reported CO coupling by diboryne systems is such a facile process.
Publisher
Royal Society of Chemistry (RSC)
Subject
Inorganic Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2016/DT/C5DT03799A
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