Orbital-Based Rationalizations of Fine-Tuning of Luminescent Materials--The pi-Nature of Substituents and Their Site-Dependent Characteristics

博士 === 國立成功大學 === 化學系碩博士班 === 100 === Through analysis HOMO or LUMO formed by Linear Combination of Bond Orbitals (LCBO), in methylated Ir(ppz)23iq (ppz=1-phenylpyrazole and 3iq=isoquinoline-3-carboxylate), it is seen that both C-H bonding and antibonding (Sigma CH and Sigma*CH) of methyl contribute...

Full description

Bibliographic Details
Main Authors: Wei-LinSu, 蘇煒林
Other Authors: Shao-Pin Wang
Format: Others
Language:en_US
Published: 2012
Online Access:http://ndltd.ncl.edu.tw/handle/23369540402077079348