π-Conjugated N-heterocyclic compounds:: correlation of computational and electrochemical data

被引:15
作者
Al-Anber, M [1 ]
Vartsadze, S
Holze, R
Lang, H
Thiel, WR
机构
[1] Mutah Univ, Fac Sci, Dept Chem Sci, Al Karak, Jordan
[2] Moscow MV Lomonosov State Univ, Dept Chem, Moscow 119992, Russia
[3] Tech Univ Chemnitz, Fac Nat Wissensch, Inst Chem, D-09111 Chemnitz, Germany
[4] Univ Kaiserslautern, Fachbereich Chem, D-67663 Kaiserslautern, Germany
关键词
D O I
10.1039/b508314a
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
Electrochemical reduction potentials of a broad selection of nitrogen-containing molecules suitable as bridging (dipodal and tripodal) ligands in coordination and organometallic chemistry are reported and compared with results of semiempirical calculations. Trends of electrode potentials observed experimentally agree with respective calculated data, deviations can be explained by invoking peculiarities of the involved molecular orbitals and ligand-electrode surface interactions.
引用
收藏
页码:3632 / 3637
页数:6
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