标题:Theoretical elucidation of the dual role of [HMIm]BF_4 IL as catalyst and extractant in the oxidative Desulfurization of DBT
作者:Hao Xu;Yuanyuan Qi;Zhe Han;Dongju Zhang;
作者机构:[Hao Xu;Yuanyuan Qi;Zhe Han;Dongju Zhang]Institute of Theoretical Chemistry,Shandong University
会议名称:中国化学会第十二届全国量子化学会议
来源:中国化学会第十二届全国量子化学会议论文摘要集
出版年:2014
关键词:BF;HMIm]BF_4 IL as catalyst and extractant in the oxidative Desulfurization of DBT;Theoretical elucidation of the dual role of;IL;
摘要:Focusing on a model system,i.e.the oxidative desulfurization(ODS)of dibenzothiophene(DBT)using H2O2 as oxidant in[HMIm]BF4 ionic liquid(IL),this work presents a theoretical elucidation of the dual role of IL as catalyst and extractant by performing DFT calculations.It is found that as a catalyst,bot...
资源类型:会议论文
原文链接:http://kns.cnki.net/kns/detail/detail.aspx?FileName=ZGHY201406001429&DbName=CPFD2015
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