Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents
Тип публикации: Journal Article
Дата публикации: 2019-03-25
scimago Q1
wos Q1
БС1
SJR: 3.782
CiteScore: 19.5
Impact factor: 13.1
ISSN: 21555435
General Chemistry
Catalysis
Краткое описание
Reversible leaching of palladium nanoparticles occurs in a variety of catalytic reactions including cross-couplings, amination, the Heck reaction, etc. It is complemented by capturing of soluble palladium species on the surface of nanoparticles and de novo formation of nanoparticles from Pd precatalysts. We report here a detailed computational study of leaching/capture pathways and analysis of related stabilization energies. We demonstrate the validity of the “cocktail-of-species” model for the description of Pd catalysts in ArX oxidative-addition-dependent reactions. Three pools of Pd species were evaluated, including (1) the pool of catalytically active Pd nanoparticles with a high concentration of surface defects, (2) the pool of monomeric and oligomeric L[ArPdX]nL species, and (3) the pool of irreversibly deactivated Pd. Stabilization by ArX oxidative addition, coordination of base species, and binding of X– anions were found to be crucial for “cocktail”-type systems, and the corresponding reaction en...
Найдено
Ничего не найдено, попробуйте изменить настройки фильтра.
Найдено
Ничего не найдено, попробуйте изменить настройки фильтра.
Топ-30
Журналы
|
1
2
3
4
5
6
7
|
|
|
ACS Catalysis
7 публикаций, 7.61%
|
|
|
Journal of the American Chemical Society
6 публикаций, 6.52%
|
|
|
Angewandte Chemie - International Edition
5 публикаций, 5.43%
|
|
|
Angewandte Chemie
5 публикаций, 5.43%
|
|
|
Catalysis Science and Technology
4 публикации, 4.35%
|
|
|
Inorganic Chemistry Frontiers
3 публикации, 3.26%
|
|
|
Organometallics
3 публикации, 3.26%
|
|
|
Chemical Science
3 публикации, 3.26%
|
|
|
Russian Chemical Reviews
3 публикации, 3.26%
|
|
|
Coordination Chemistry Reviews
2 публикации, 2.17%
|
|
|
Journal of Catalysis
2 публикации, 2.17%
|
|
|
ChemistrySelect
2 публикации, 2.17%
|
|
|
Faraday Discussions
2 публикации, 2.17%
|
|
|
Organic Chemistry Frontiers
2 публикации, 2.17%
|
|
|
RSC Advances
2 публикации, 2.17%
|
|
|
New Journal of Chemistry
2 публикации, 2.17%
|
|
|
Kinetics and Catalysis
2 публикации, 2.17%
|
|
|
Russian Chemical Bulletin
2 публикации, 2.17%
|
|
|
Journal of Organic Chemistry
2 публикации, 2.17%
|
|
|
Inorganic Chemistry
1 публикация, 1.09%
|
|
|
European Journal of Organic Chemistry
1 публикация, 1.09%
|
|
|
European Journal of Inorganic Chemistry
1 публикация, 1.09%
|
|
|
Catalysts
1 публикация, 1.09%
|
|
|
Molecules
1 публикация, 1.09%
|
|
|
Processes
1 публикация, 1.09%
|
|
|
Nature Communications
1 публикация, 1.09%
|
|
|
Journal of Molecular Graphics and Modelling
1 публикация, 1.09%
|
|
|
Catalysis Communications
1 публикация, 1.09%
|
|
|
Tetrahedron Letters
1 публикация, 1.09%
|
|
|
Inorganica Chimica Acta
1 публикация, 1.09%
|
|
|
1
2
3
4
5
6
7
|
Издатели
|
5
10
15
20
25
|
|
|
American Chemical Society (ACS)
23 публикации, 25%
|
|
|
Wiley
20 публикаций, 21.74%
|
|
|
Royal Society of Chemistry (RSC)
19 публикаций, 20.65%
|
|
|
Elsevier
14 публикаций, 15.22%
|
|
|
MDPI
4 публикации, 4.35%
|
|
|
Pleiades Publishing
4 публикации, 4.35%
|
|
|
Springer Nature
3 публикации, 3.26%
|
|
|
Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
3 публикации, 3.26%
|
|
|
OOO Zhurnal "Mendeleevskie Soobshcheniya"
1 публикация, 1.09%
|
|
|
The Russian Academy of Sciences
1 публикация, 1.09%
|
|
|
5
10
15
20
25
|
- Мы не учитываем публикации, у которых нет DOI.
- Статистика публикаций обновляется еженедельно.
Вы ученый?
Создайте профиль, чтобы получать персональные рекомендации коллег, конференций и новых статей.
Метрики
92
Всего цитирований:
92
Цитирований c 2025:
15
(16.3%)
Цитировать
ГОСТ |
RIS |
BibTex |
MLA
Цитировать
ГОСТ
Скопировать
Polynski M. V. et al. Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents // ACS Catalysis. 2019. Vol. 9. No. 5. pp. 3991-4005.
ГОСТ со всеми авторами (до 50)
Скопировать
Polynski M. V., Ananikov V. P. Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents // ACS Catalysis. 2019. Vol. 9. No. 5. pp. 3991-4005.
Цитировать
RIS
Скопировать
TY - JOUR
DO - 10.1021/acscatal.9b00207
UR - https://doi.org/10.1021/acscatal.9b00207
TI - Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents
T2 - ACS Catalysis
AU - Polynski, Mikhail V
AU - Ananikov, Valentine P
PY - 2019
DA - 2019/03/25
PB - American Chemical Society (ACS)
SP - 3991-4005
IS - 5
VL - 9
SN - 2155-5435
ER -
Цитировать
BibTex (до 50 авторов)
Скопировать
@article{2019_Polynski,
author = {Mikhail V Polynski and Valentine P Ananikov},
title = {Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents},
journal = {ACS Catalysis},
year = {2019},
volume = {9},
publisher = {American Chemical Society (ACS)},
month = {mar},
url = {https://doi.org/10.1021/acscatal.9b00207},
number = {5},
pages = {3991--4005},
doi = {10.1021/acscatal.9b00207}
}
Цитировать
MLA
Скопировать
Polynski, Mikhail V., et al. “Modeling Key Pathways Proposed for the Formation and Evolution of “Cocktail”-Type Systems in Pd-Catalyzed Reactions Involving ArX Reagents.” ACS Catalysis, vol. 9, no. 5, Mar. 2019, pp. 3991-4005. https://doi.org/10.1021/acscatal.9b00207.
Профили