volume 52 issue 28 pages 5057-5060

Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII

Yasamin Younesi 1, 2, 3, 4, 5
Bahare Nasiri 1, 2, 3, 4, 5
Rasool Babaahmadi 3, 4, 5, 6, 7
Charlotte Willans 8, 9, 10, 11
Ian J.S Fairlamb 1, 11, 12, 13
Alireza Ariafard 1, 2, 3, 4, 5
1
 
DEPARTMENT OF CHEMISTRY
2
 
Faculty of science
3
 
Central Tehran Branch
5
 
Tehran
6
 
Young Researchers and Elite Club
7
 
Iran
8
 
School of chemistry
10
 
Leeds LS2 9JT
11
 
UK
13
 
York YO10 5DD
Publication typeJournal Article
Publication date2016-03-18
scimago Q1
wos Q2
SJR1.037
CiteScore7.4
Impact factor4.2
ISSN13597345, 1364548X
PubMed ID:  26987349
Materials Chemistry
Metals and Alloys
Surfaces, Coatings and Films
General Chemistry
Ceramics and Composites
Electronic, Optical and Magnetic Materials
Catalysis
Abstract

A dichotomy in carbon versus bromide reductive elimination in CuIII–NHC complexes is rationalized by computational methods (DFT).

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GOST Copy
Younesi Y. et al. Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII // Chemical Communications. 2016. Vol. 52. No. 28. pp. 5057-5060.
GOST all authors (up to 50) Copy
Younesi Y., Nasiri B., Babaahmadi R., Willans C., Fairlamb I. J., Ariafard A. Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII // Chemical Communications. 2016. Vol. 52. No. 28. pp. 5057-5060.
RIS |
Cite this
RIS Copy
TY - JOUR
DO - 10.1039/c6cc01299j
UR - https://doi.org/10.1039/c6cc01299j
TI - Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII
T2 - Chemical Communications
AU - Younesi, Yasamin
AU - Nasiri, Bahare
AU - Babaahmadi, Rasool
AU - Willans, Charlotte
AU - Fairlamb, Ian J.S
AU - Ariafard, Alireza
PY - 2016
DA - 2016/03/18
PB - Royal Society of Chemistry (RSC)
SP - 5057-5060
IS - 28
VL - 52
PMID - 26987349
SN - 1359-7345
SN - 1364-548X
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{2016_Younesi,
author = {Yasamin Younesi and Bahare Nasiri and Rasool Babaahmadi and Charlotte Willans and Ian J.S Fairlamb and Alireza Ariafard},
title = {Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII},
journal = {Chemical Communications},
year = {2016},
volume = {52},
publisher = {Royal Society of Chemistry (RSC)},
month = {mar},
url = {https://doi.org/10.1039/c6cc01299j},
number = {28},
pages = {5057--5060},
doi = {10.1039/c6cc01299j}
}
MLA
Cite this
MLA Copy
Younesi, Yasamin, et al. “Theoretical rationalisation for the mechanism of N-heterocyclic carbene-halide reductive elimination at CuIII, AgIII and AuIII.” Chemical Communications, vol. 52, no. 28, Mar. 2016, pp. 5057-5060. https://doi.org/10.1039/c6cc01299j.
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