Theoretical evaluation of the carbene-based site-selectivity in gold(iii)-catalyzed annulations of alkynes with anthranils
文献类型：期刊论文
| 作者 | Wang, Kaifeng; Wu, Qiao; Bi, Siwei; Liu, Lingjun; Chen, Guang; Li, Yulin ; James, Tony D.; Liu, Yuxia
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| 刊名 | CHEMICAL COMMUNICATIONS
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| 出版日期 | 2021 |
| 卷号 | 57期号:12 |
| 英文摘要 | The gold(iii)-catalyzed annulations of alkynes with anthranils were evaluated using DFT calculations. A unified rationale for the Br-migration on alpha-imino gold(iii)-carbene was proposed, from which an unprecedented N-donation/abstraction substitution mechanism was established using the substituted anthranils, while direct C-H nucleophilic attack was involved with the unsubstituted anthranils. The controlling factors guiding the site-selectivity were uncovered. These computational studies provide insight for developing new alpha-imino gold(iii)-carbene mediated reactions. |
| 源URL | [http://210.75.249.4/handle/363003/60853]  |
| 专题 | 西北高原生物研究所_中国科学院西北高原生物研究所 |
| 推荐引用方式 GB/T 7714 | Wang, Kaifeng,Wu, Qiao,Bi, Siwei,et al. Theoretical evaluation of the carbene-based site-selectivity in gold(iii)-catalyzed annulations of alkynes with anthranils[J]. CHEMICAL COMMUNICATIONS,2021,57(12). |
| APA | Wang, Kaifeng.,Wu, Qiao.,Bi, Siwei.,Liu, Lingjun.,Chen, Guang.,...&Liu, Yuxia.(2021).Theoretical evaluation of the carbene-based site-selectivity in gold(iii)-catalyzed annulations of alkynes with anthranils.CHEMICAL COMMUNICATIONS,57(12). |
| MLA | Wang, Kaifeng,et al."Theoretical evaluation of the carbene-based site-selectivity in gold(iii)-catalyzed annulations of alkynes with anthranils".CHEMICAL COMMUNICATIONS 57.12(2021). |
入库方式： OAI收割
来源：西北高原生物研究所
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