Transient Innermolecular Carbene-Hemicarcerand Complex of Fluorophenylcarbene

被引：1

作者：

Lu, Zhifeng ^{[1
]}

Moss, Robert A. ^{[1
]}

Warmuth, Ralf ^{[1
]}

Krogh-Jespersen, Karsten ^{[1
]}

机构：

[1] Rutgers State Univ, Dept Chem & Chem Biol, New Brunswick, NJ 08903 USA

来源：

JOURNAL OF PHYSICAL CHEMISTRY A | 2011年 / 115卷 / 47期

基金：

美国国家科学基金会;

关键词：

INNER PHASE; BASIS-SETS; SOLVATION; DICHLOROCARBENE; ENERGIES; BINDING;

D O I：

10.1021/jp2087785

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Laser flash photolysis of fluorophenyldiazirine incarcerated in hemicarcerand 2 affords incarcerated fluorophenylcarbene [2 circle dot 3], which forms a meta-stable, innermolecular pi-complex with aryl moieties of 2. This carbene complex can be observed spectroscopically. Extensive computational studies provide insights into the structure, spectroscopy, energetics, and kinetics of the 2 circle dot 3 carbene complex.

引用

页码：13799 / 13803

页数：5

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