<b>Theoretical study on electronic structures and spectroscopy of triarylborane substituted by thiophene</b>

The electronic structures of a series of triarylborane derivatives were studied using the AM1 method and density function theory (DFT) at B3LYP/6-31G(d) level. Based on the B3LYP/6-31G(d) optimized geometries, the electronic spectra, IR and <sup>13</sup>C NMR spectra of these compounds w...

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Bibliographic Details
Main Authors: Ye Zhang, Ting Li, Qiwen Teng
Format: Article
Language:English
Published: Chemical Society of Ethiopia 2009-04-01
Series:Bulletin of the Chemical Society of Ethiopia
Subjects:
Online Access:http://www.ajol.info/index.php/bcse/article/view/21301