Photodissociation of acryloyl chloride at 193 nm: interpretation of the product energy distributions, and new elimination pathways
Author:
Affiliation:
1. Departamento de Química Física and Centro Singular de Investigación en Química Biológica y Materiales Moleculares (CIQUS)
2. Campus Vida
3. Universidade de Santiago de Compostela
4. Santiago de Compostela
5. Spain
Abstract
The use of an automated TS search method leads to the finding of novel HCl elimination pathways.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2016/CP/C5CP07759A
Reference68 articles.
1. Ab initio and RRKM study of the elimination of HF and HCl from chlorofluoroethylene
2. Rotational distributions of HBr in the photodissociation of vinyl bromide at 193nm: An investigation by direct quasiclassical trajectory calculations
3. Quasiclassical trajectory calculations on the photodissociation of CF2CHCl at 193nm: Product energy distributions for the HF and HCl eliminations
4. Further investigation of the HCl elimination in the photodissociation of vinyl chloride at 193 nm: a direct MP2/6-31G(d,p) trajectory study
5. Rovibrational distributions of HF in the photodissociation of vinyl fluoride at 193 nm: A direct MP2 quasiclassical trajectory study
Cited by 12 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. Automatic Determination of the Non‐Covalent Stable Conformations of the NO2‐Pyrene Cluster in Full Dimensionality (81D) Using the vdW‐TSSCDS Approach;ChemPhysChem;2024-04-25
2. New Tools for Taming Complex Reaction Networks: The Unimolecular Decomposition of Indole Revisited;ACS Physical Chemistry Au;2022-02-04
3. Determination of kinetic properties in unimolecular dissociation of complex systems from graph theory based analysis of an ensemble of reactive trajectories;The Journal of Chemical Physics;2021-09-28
4. AutoMeKin2021 : An open‐source program for automated reaction discovery;Journal of Computational Chemistry;2021-08-13
5. Photodissociation of Benzoyl Chloride: A Velocity Map Imaging Study Using VUV Detection of Chlorine Atoms;The Journal of Physical Chemistry A;2021-04-05
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