Rationalization of the mechanism and chemoselectivity of versatile Au-catalyzed reactions of diazoesters with allyl-functionalized sulfides, selenides, amines, or ethers by DFT-Reference-Cited by-同舟云学术

Rationalization of the mechanism and chemoselectivity of versatile Au-catalyzed reactions of diazoesters with allyl-functionalized sulfides, selenides, amines, or ethers by DFT

Published:2021 Issue:21 Volume:8 Page:6053-6062
ISSN:2052-4129
Container-title:Organic Chemistry Frontiers
language:en
Short-container-title:Org. Chem. Front.

Author:

Gao Caicai¹,Cao Teng¹,Kirillov Alexander M.²³^ORCID,Fang Ran¹^ORCID,Yang Lizi⁴^ORCID

Affiliation:

1. Key Laboratory of Chemical Additives for China National Light Industry, College of Chemistry and Chemical Engineering, Shaanxi University of Science and Technology, Xi'an 710021, P. R. China

2. Centro de Química Estrutural and Departamento de Engenharia Química, Instituto Superior Técnico, Universidade de Lisboa, Av. Rovisco Pais, 1049-001, Lisbon, Portugal

3. Research Institute of Chemistry, Peoples’ Friendship University of Russia (RUDN University), 6 Miklukho-Maklaya st., Moscow, 117198, Russian Federation

4. College of Chemistry and Chemical Engineering, Lanzhou University, Lanzhou 730000, P. R. China

Abstract

The origin of chemoselectivity and the mechanism of the title reactions were fully rationalized by density functional theory (DFT).

Funder

National Natural Science Foundation of China

Fundação para a Ciência e a Tecnologia

RUDN University

Publisher

Royal Society of Chemistry (RSC)

Subject

Organic Chemistry

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