Theoretical investigation on the nature of substituted benzene⋯AuX interactions: covalent or noncovalent?
Aiting ShanHebei Key Laboratory of Inorganic Nano-materials, College of Chemistry and Materials Science, Hebei Normal University, Shijiazhuang, 050024, P. R. ChinaXiaoyan LiHebei Key Laboratory of Inorganic Nano-materials, College of Chemistry and Materials Science, Hebei Normal University, Shijiazhuang, 050024, P. R. ChinaYanli ZengHebei Key Laboratory of Inorganic Nano-materials, College of Chemistry and Materials Science, Hebei Normal University, Shijiazhuang, 050024, P. R. ChinaLingpeng MengHebei Key Laboratory of Inorganic Nano-materials, College of Chemistry and Materials Science, Hebei Normal University, Shijiazhuang, 050024, P. R. ChinaXueying ZhangHebei Key Laboratory of Inorganic Nano-materials, College of Chemistry and Materials Science, Hebei Normal University, Shijiazhuang, 050024, P. R. China
2022en
ABI
Abstract
The nature of interactions between AuX (X = F, Cl, Br, CN, NO 2 , CH 3 ) and aromatic moieties with different electronic properties has been investigated for possible tuning of coinage–metal bonds by varying the substituents.
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