Orthogonal reactivity of Ni(i)Pd(0) dual catalysts for Ullmann C-C cross-coupling theoretical insight
文献类型：期刊论文
| 作者 | Zhu, B.; Yan, L. K.; Yao, L. S.; Ren, H. ; Li, R. H.; Guan, W.; Su, Z. M.
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| 刊名 | Chemical Communications
 |
| 出版日期 | 2018 |
| 卷号 | 54期号:57页码:7959-7962 |
| 关键词 | 2-state reactivity titanium hydride bond formation activation mechanisms electrophiles perspective molecules energies benzene Chemistry |
| ISSN号 | 1359-7345 |
| DOI | 10.1039/c8cc04127j |
| 英文摘要 | Dual catalysis has become a desirable alternative because of the synergetic effect of two distinct catalysts, but little is known about the mechanism of dual catalysis and its effect on the high reactivity and selectivity. Here, a novel Ullmann C-C cross-coupling of bromobenzene and 4-methoxyphenyltriflate via nickel/palladium dual catalysis has been investigated using density functional theory. The orthogonal reactivity of Ni-I/Pd-0 combination is the precondition and foundation of achieving such a Ullmann cross-coupling reaction. In the present dual catalysis, the Ni-I complex acts as the primary catalyst, while the Pd-0 catalyst plays a decisive role in the cross-selectivity. |
| 源URL | [http://ir.ciomp.ac.cn/handle/181722/60759]  |
| 专题 | 中国科学院长春光学精密机械与物理研究所 |
| 推荐引用方式 GB/T 7714 | Zhu, B.,Yan, L. K.,Yao, L. S.,et al. Orthogonal reactivity of Ni(i)Pd(0) dual catalysts for Ullmann C-C cross-coupling theoretical insight[J]. Chemical Communications,2018,54(57):7959-7962. |
| APA | Zhu, B..,Yan, L. K..,Yao, L. S..,Ren, H..,Li, R. H..,...&Su, Z. M..(2018).Orthogonal reactivity of Ni(i)Pd(0) dual catalysts for Ullmann C-C cross-coupling theoretical insight.Chemical Communications,54(57),7959-7962. |
| MLA | Zhu, B.,et al."Orthogonal reactivity of Ni(i)Pd(0) dual catalysts for Ullmann C-C cross-coupling theoretical insight".Chemical Communications 54.57(2018):7959-7962. |
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