Cyclodehydrogenation reactions to cyclopentafused polycyclic aromatic hydrocarbons

Violi A

首页> 外文期刊>The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory >Cyclodehydrogenation reactions to cyclopentafused polycyclic aromatic hydrocarbons

【24h】

Cyclodehydrogenation reactions to cyclopentafused polycyclic aromatic hydrocarbons

机译：环戊氢化的多环芳烃的环十二氢化反应

获取原文

获取原文并翻译 | 示例

掌桥外文数据库（机构版） >>

开具论文收录证明 >>

文献代查 >>

页面导航

摘要
著录项
相似文献
相关主题

摘要

B3LYP/6-31G(d,p) electronic structure calculations are employed to elucidate the reaction mechanisms for the conversion of the alternant C18H12 polycyclic aromatic hydrocarbon benzo[c]phenanthrene into the nonalternant C18H10 PAHs cyclopenta[cd]pyrene and benzo[ghi]fluoranthene. Isomerization reactions such as 5/6-ring switching and hydrogen atom scrambling are analyzed. Bay region chemistry, involving the rupture of one benzene ring followed by the formation of a new five-membered ring, is also studied, together with the mechanism for the formation of an aryne. The rearrangement of the latter yields annelated cyclopenta-dienylidenecarbene, which is then trapped intramolecularly.

机译：B3LYP / 6-31G（d，p）电子结构计算用于阐明将交替的C18H12多环芳烃苯并[c]菲转化为非替代的C18H10 PAHs环戊[cd] py和苯并[ghi]的反应机理荧蒽。分析了异构化反应，例如5/6环切换和氢原子加扰。还研究了湾区化学，包括一个苯环的断裂，然后形成一个新的五元环，以及形成芳烃的机理。后者的重排产生了退火的环戊二烯二烯，然后被分子内捕获。

著录项

来源
《The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory》 |2005年第34期|共7页
作者
Violi A;
展开▼
作者单位

展开▼
收录信息
原文格式 PDF
正文语种 eng
中图分类
关键词
THERMAL REARRANGEMENTS; ELECTRONIC-STRUCTURE; HIGH-TEMPERATURES; 5-MEMBERED RINGS; ARYL RADICALS; ORTHO-BENZYNE; BENZENE-RING; PYROLYSIS; IDENTIFICATION; ACEANTHRYLENE;

机译：热重排列;电子结构;高温;5元环;芳基自由基;邻苯甲醛;苯环;热解;鉴定;对乙炔;

相似文献

外文文献
中文文献
专利

1. Cyclodehydrogenation reactions to cyclopentafused polycyclic aromatic hydrocarbons [J] . Violi A The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2005,第34期

机译：环戊氢化的多环芳烃的环十二氢化反应
2. Building Pentagons into Graphenic Structures by On-Surface Polymerization and Aromatic Cyclodehydrogenation of Phenyl-Substituted Polycyclic Aromatic Hydrocarbons [J] . Liu Jia, Dienel Thomas, Liu Junzhi, The journal of physical chemistry, C. Nanomaterials and interfaces . 2016,第31期

机译：通过苯取代的多环芳烃的表面聚合和芳族环十二氢化将五边形构建为斜方结构。
3. LOW BAND GAP MATERIALS FROM CYCLOPENTAFUSED POLYCYCLIC AROMATIC HYDROCARBONS [J] . Kyle N. Plunkett American Chemical Society, Division of Fuel Chemistry, Preprints . 2012,第2期

机译：环糊精多环芳烃的低带隙材料
4. LOW BAND GAP MATERIALS FROM CYCLOPENTAFUSED POLYCYCLIC AROMATIC HYDROCARBONS [C] . Kyle N. Plunkett National Meeting Exhibition . 2012

机译：来自环戊酰胺多环芳烃的低带隙材料
5. Mechanistic studies on the thermal cyclodehydrogenations of polycyclic aromatic hydrocarbons. [D] . Xue, Xiang. 2008

机译：多环芳烃热环脱氢的机理研究。
6. Cyclodextrin-promoted Diels Alder reactions of a polycyclic aromatic hydrocarbon under mild reaction conditions [O] . Sauradip Chaudhuri, Tyler Phelan, Mindy Levine -1

机译：温和的反应条件下多环芳烃的环糊精促进的Diels Alder反应
7. Building Pentagons into Graphenic Structures by On-Surface Polymerization and Aromatic Cyclodehydrogenation of Phenyl-Substituted Polycyclic Aromatic Hydrocarbons [O] . Liu, Jia, Dienel, Thomas, Liu, Junzhi, 2016

机译：通过苯取代的多环芳烃的表面聚合和芳族环十二氢化将五边形构建为斜方结构。

Cyclodehydrogenation reactions to cyclopentafused polycyclic aromatic hydrocarbons

摘要

著录项

相似文献

相关主题

期刊订阅