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4 articles related to "Substituent Effect"

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Articles

Original Research

Published on 16 Nov 2022

Mechanistic insights into reductive deamination with hydrosilanes catalyzed by B(C6F5)3: A DFT study

in Theoretical and Computational Chemistry

Miaomiao Zhou
Ting Wang
Gui-Juan Cheng

Frontiers in Chemistry

doi 10.3389/fchem.2022.1025135

3,993 views

Original Research

Published on 10 Jan 2022

DFT Study on the Substituent Effect of Anticancer Picoline-Diazido-Pt(IV) Compounds

in Pharmacology of Anti-Cancer Drugs

Meilin Mu
Hongwei Gao

Frontiers in Oncology

doi 10.3389/fonc.2021.749178

3,529 views
4 citations

Original Research

Published on 16 Dec 2024

Homogenous catalysis of peroxynitrite conversion to nitrate by diaryl selenide: a theoretical investigation of the reaction mechanism

in Theoretical and Computational Chemistry

Yuan Xue
Carrie Salmon
Valentin Gogonea

Frontiers in Chemistry

doi 10.3389/fchem.2024.1486175

1,413 views

Original Research

Published on 27 Jan 2022

Efficient Room-Temperature Phosphorescence from Discrete Molecules Based on Thianthrene Derivatives for Oxygen Sensing and Detection

in Chemical Physics and Physical Chemistry

Zhiqiang Yang
Shuaiqiang Zhao
Xiangyu Zhang
Meng Liu
Haichao Liu
Bing Yang

Frontiers in Chemistry

doi 10.3389/fchem.2021.810304

5,827 views
27 citations