Synthesis and characterization of iron and ruthenium complexes bearing P-N ligands based on 8-hydroxyquinoline

被引：10

作者：

Benito-Garagorri, David ^{[1
]}

Lackner-Warton, Wolfgang ^{[1
]}

Standfest-Hauser, Christina M. ^{[1
]}

Mereiter, Kurt ^{[2
]}

Kirchner, Karl ^{[1
]}

机构：

[1] Vienna Univ Technol, Inst Appl Synthet Chem, A-1060 Vienna, Austria

[2] Vienna Univ Technol, Inst Chem Technol & Analyt, A-1060 Vienna, Austria

来源：

INORGANICA CHIMICA ACTA | 2010年 / 363卷 / 14期

关键词：

Phosphinito quinoline ligands; Iron complexes; Ruthenium complexes/carbonyl complexes; DFT calculations; POLARIZABLE CONTINUUM MODEL; GAUSSIAN-BASIS SETS; PINCER-TYPE LIGANDS; COORDINATION CHEMISTRY; MOLECULAR CALCULATIONS; SOLVATION MODELS; ROW ATOMS; DENSITY; PNP; CATALYSIS;

D O I：

10.1016/j.ica.2010.05.019

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

The synthesis of bidentate aminophosphine ligands (PNquin) based on 8-hydroxyquinoline is described. These ligands react with cis-Fe(CO)(4)Br-2 to give selectively octahedral complexes of the type cis, cis-Fe(PNquin)(CO)Br-2(2). There is only one isomer formed where the two CO and the two bromide ligands adopt a cis configuration. The reaction of [RuCp(CH3CN)(3)]PF6 with PNquin ligands affords the halfsandwich complexes [RuCp(PNquin)(CH3CN)]PF6 in high isolated yields. Likewise, treatment of [Ru(eta(6)-p-cymene)(mu-Cl) Cl](2) with PNquin in the presence of AgCF3SO3 affords halfsandwich complexes of the type [Ru(eta(6)-pcymene)(PNquin) Cl]CF3SO3. All ligands and complexes are characterized by NMR and IR spectroscopy. The X-ray structure of representative compounds is reported. In addition, the relative stability of isomeric structures and conformers of Fe(PNquin-Ph)(CO)(2)Br-2 is studied by means of DFT calculations. (c) 2010 Elsevier B. V. All rights reserved.

引用

页码：3674 / 3679

页数：6

共 42 条

[41] Quantum mechanical continuum solvation models
Tomasi, J
Mennucci, B
Cammi, R
[J]. CHEMICAL REVIEWS, 2005, 105 (08) : 2999 - 3093
[42] GAUSSIAN BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING THIRD-ROW ATOMS
WACHTERS, AJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (03) : 1033 - &

← 1 2 3 4 5 →