Theoretical NMR spectroscopy of N-heterocyclic carbenes and their metal complexes

被引：29
|
作者：
Falivene, Laura [1 ]
Cavallo, Luigi [1 ]
机构：
[1] King Abdullah Univ Sci & Technol, Kaust Catalysis Ctr, Phys Sci & Engn Div, Thuwal 239556900, Saudi Arabia
来源：
COORDINATION CHEMISTRY REVIEWS | 2017年 / 344卷
关键词：
N-heterocyclic carbenes; Density functional theory; Nuclear magnetic resonance; pi-Acidity; sigma-Donicity; Paramagnetic shielding; DENSITY-FUNCTIONAL THEORY; CHEMICAL-SHIFTS; SHIELDING CONSTANTS; LIGAND PROPERTIES; CATALYSTS; TENSORS; PERFORMANCE; PREDICTION; REACTIVITY; METHYLENE;
D O I：
10.1016/j.ccr.2016.12.015
中图分类号：
O61 [无机化学];
学科分类号：
070301 ; 081704 ;
摘要：
Recent theoretical analysis of the NMR properties of free N-heterocyclic carbenes (NHC) and metal-NHC complexes has complemented experiments, allowing the establishment of structure/property relationships and the rationalization of otherwise surprising experimental results. In this review, the main conclusions from recent literature are discussed, with the aim to offer a vision of the potential of theoretical analyses of NMR properties. (C) 2016 Elsevier B.V. All rights reserved.
引用
收藏
页码：101 / 114
页数：14
相关论文
共 50 条
  • [1] Synthesis of N-Heterocyclic Carbenes and Metal Complexes
    Jiang Lan
    Li Zhengning
    Zhao Defeng
    [J]. PROGRESS IN CHEMISTRY, 2009, 21 (06) : 1229 - 1240
  • [2] Group 7 transition metal complexes with N-heterocyclic carbenes
    Hock, Sebastian J.
    Schaper, Lars-Arne
    Herrmann, Wolfgang A.
    Kuehn, Fritz E.
    [J]. CHEMICAL SOCIETY REVIEWS, 2013, 42 (12) : 5073 - 5089
  • [3] New annulated N-heterocyclic carbenes and their transition metal complexes
    Bettler, Graeme
    Changas, Angelo
    Buckner, Ossie
    Boudreaux, Chance
    Norvell, Bradley
    Tapu, Daniela
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
  • [4] N-heterocyclic carbenes as bridgehead donors in metal pincer complexes
    He, Fengkai
    Zois, Konstantinos P.
    Tzeli, Demeter
    Danopoulos, Andreas A.
    Braunstein, Pierre
    [J]. COORDINATION CHEMISTRY REVIEWS, 2024, 514
  • [5] Synthesis of bis N-heterocyclic carbenes, derivatives and metal complexes
    Huffer, Arlanda
    Jeffery, Ben
    Waller, Benjamin J.
    Danopoulos, Andreas A.
    [J]. COMPTES RENDUS CHIMIE, 2013, 16 (06) : 557 - 565
  • [6] Bisimidazole based N-heterocyclic carbenes and their metal complexes.
    Panzner, MJ
    Medvetz, DA
    Youngs, WJ
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 228 : U816 - U816
  • [7] N-Heterocyclic Carbenes-CuI Complexes as Catalysts: A Theoretical Insight
    Beig, Nosheen
    Goyal, Varsha
    Gupta, Raakhi
    Bansal, Raj K.
    [J]. AUSTRALIAN JOURNAL OF CHEMISTRY, 2021, 74 (07) : 503 - 513
  • [8] Group 12 Metal Complexes of N-Heterocyclic Ditopic Carbanionic Carbenes
    Waters, Jordan B.
    Turbervill, Robert S. P.
    Goicoechea, Jose M.
    [J]. ORGANOMETALLICS, 2013, 32 (18) : 5190 - 5200
  • [9] Quinone-annulated N-heterocyclic carbenes and their transition metal complexes
    Bielawski, Christopher W.
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2007, 233 : 790 - 790
  • [10] Coinage metal complexes of selenoureas derived from N-heterocyclic carbenes
    Nahra, Fady
    Van Hecke, Kristof
    Kennedy, Alan R.
    Nelson, David J.
    [J]. DALTON TRANSACTIONS, 2018, 47 (31) : 10671 - 10684
12345