Computational insights into radical hydrogenation of alkenes and naphthalenes with Ar<sub>3</sub>P–OH radical

The Ar 3 P–OH radical-mediated hydrogenation of closed-shell π systems proceeds through a concerted proton-coupled electron transfer (cPCET) pathway rather than a hydrogen atom transfer (HAT) mechanism.

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Publication Details

Journal
Catalysis Science & Technology
Published
2025-01-01
DOI
https://doi.org/10.1039/d5cy00899a
Primary Topic
Machine Learning in Materials Science
Type
article
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article

Computational insights into radical hydrogenation of alkenes and naphthalenes with Ar3P–OH radical

Lingfei Hu, Xiangying Lv, Gang Lü, Limeng Wang
Catalysis Science & Technology
Machine Learning in Materials Science
article

Computational insights into radical hydrogenation of alkenes and naphthalenes with Ar3P–OH radical

Lingfei Hu, Xiangying Lv, Gang Lü, Limeng Wang
article en

Abstract

The Ar 3 P–OH radical-mediated hydrogenation of closed-shell π systems proceeds through a concerted proton-coupled electron transfer (cPCET) pathway rather than a hydrogen atom transfer (HAT) mechanism.

Catalysis Science & TechnologyVol. 15(18)
Shandong University (CN)
Openalex Percentile: Top 83%
Machine Learning in Materials Science
DOISourceOpenAlex
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Computational insights into radical hydrogenation of alkenes and naphthalenes with Ar<sub>3</sub>P–OH radical — Lingfei Hu, Xiangying Lv, et al. · Catalysis Science & Technology (2025) | TGRS Research Map | TGRS