Promotion Energy Analysis Predicts Reaction Modes: Nucleophilic and Electrophilic Aromatic Substitution Reactions
Author:
Affiliation:
1. Institute of Chemistry, The Hebrew University, Jerusalem 91904, Israel
Funder
Israel Science Foundation
Fonds Wetenschappelijk Onderzoek
Publisher
American Chemical Society (ACS)
Subject
Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis
Link
https://pubs.acs.org/doi/pdf/10.1021/jacs.1c00307
Reference60 articles.
1. Methods for exploring reaction space in molecular systems
2. Finding reaction mechanisms, intuitive or otherwise
3. Complex Chemical Reaction Networks from Heuristics-Aided Quantum Chemistry
4. Automated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods
5. Discovering chemistry with an ab initio nanoreactor
Cited by 13 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. An environment-friendly phosphotungstic acid catalyzed cross-dehydrogenative coupling reaction to synthesize 9-substituted-9 H -xanthenes with photoelectrochemical performance;Synthetic Communications;2024-09-12
2. TS‐tools: Rapid and automated localization of transition states based on a textual reaction SMILES input;Journal of Computational Chemistry;2024-06-08
3. Photochemical Degradation of the New Nicotine Pesticide Acetamiprid in Water;Bulletin of Environmental Contamination and Toxicology;2024-04
4. De novo assembly of frustrated Lewis pair bearing metal‐organic frameworks for atmospheric CO2 cycloaddition;AIChE Journal;2023-12-22
5. Effect of Substituents on Molecular Reactivity during Lignin Oxidation by Chlorine Dioxide: A Density Functional Theory Study;International Journal of Molecular Sciences;2023-07-22
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3