Mechanistic investigation of the C(sp<sup>3</sup>)–C(sp<sup>3</sup>) coupling reaction through synergistic activation of C–H/C–Br bonds by Ir/Ni catalysts

A theoretical computational study revealed the role of the hydrogen atom transfer (HAT) mechanism in activating the α-C–H bond of terminal alkenes through iridium/nickel bimetallic cooperative catalysis for C(sp 3 )–C(sp 3 ) bond formation.

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Publication Details

Journal
New Journal of Chemistry
Published
2025-01-01
DOI
https://doi.org/10.1039/d5nj02223a
Primary Topic
Asymmetric Hydrogenation and Catalysis
Type
article
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article

Mechanistic investigation of the C(sp3)–C(sp3) coupling reaction through synergistic activation of C–H/C–Br bonds by Ir/Ni catalysts

Xinxin Wang, Hui Li
New Journal of Chemistry
Asymmetric Hydrogenation and Catalysis
article

Mechanistic investigation of the C(sp3)–C(sp3) coupling reaction through synergistic activation of C–H/C–Br bonds by Ir/Ni catalysts

Xinxin Wang, Hui Li
article en

Abstract

A theoretical computational study revealed the role of the hydrogen atom transfer (HAT) mechanism in activating the α-C–H bond of terminal alkenes through iridium/nickel bimetallic cooperative catalysis for C(sp 3 )–C(sp 3 ) bond formation.

New Journal of ChemistryVol. 49(35)
State Ethnic Affairs Commission (CN)
Openalex Percentile: Top 85%
Asymmetric Hydrogenation and Catalysis
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Mechanistic investigation of the C(sp<sup>3</sup>)–C(sp<sup>3</sup>) coupling reaction through synergistic activation of C–H/C–Br bonds by Ir/Ni catalysts — Xinxin Wang, Hui Li · New Journal of Chemistry (2025) | TGRS Research Map | TGRS