Experimental and Theoretical Evidence for Relativistic Catalytic Activity in C–H Activation of <i>N</i>-Phenylbenzamide Using a Cationic Iridium Complex-Reference-Cited by-同舟云学术

Experimental and Theoretical Evidence for Relativistic Catalytic Activity in C–H Activation of N-Phenylbenzamide Using a Cationic Iridium Complex

Published:2022-10-14 Issue:42 Volume:126 Page:7627-7638
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Takashima Chinami¹^ORCID,Kurita Hisaki¹,Takano Hideaki²³^ORCID,Ikabata Yasuhiro⁴⁵,Shibata Takanori¹^ORCID,Nakai Hiromi¹⁶^ORCID

Affiliation:

1. Department of Chemistry and Biochemistry, School of Advanced Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku, Tokyo169-8555, Japan

2. Institute for Chemical Reaction Design and Discovery (WPI-ICReDD), Hokkaido University, Sapporo, Hokkaido001-0021, Japan

3. ERATO Maeda Artificial Intelligence in Chemical Reaction Design and Discovery Project, JST, Sapporo, Hokkaido060-0810, Japan

4. Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi441-8580, Japan

5. Department of Computer Science and Engineering, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi441-8580, Japan

6. Waseda Research Institute for Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku, Tokyo169-8555, Japan

Funder

Ministry of Education, Culture, Sports, Science and Technology

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c04747

Reference48 articles.

1. Relativistic effects on chemical properties

2. Relativity and the periodic system of elements

3. Relativistic effects in structural chemistry

4. Spin-orbit coupling in molecules: Chemistry beyond the adiabatic approximation

5. Dyall, K. G.; Faegri, K. Introduction to Relativistic Quantum Chemistry; Oxford University Press: New York, 2007; p 544.

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