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Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction

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10.71267/mencom.7806
Published 2025-11-29
Communication , Volume 36, Issue 1, 37-40
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Kostyukovich A. Yu., Shutovskaya E. S., Prima D. O. Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction // Mendeleev Communications. 2025. Vol. 36. No. 1. pp. 37-40.
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Kostyukovich A. Yu., Shutovskaya E. S., Prima D. O. Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction // Mendeleev Communications. 2025. Vol. 36. No. 1. pp. 37-40.
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TY - JOUR
DO - 10.71267/mencom.7806
UR - https://mendcomm.colab.ws/publications/10.71267/mencom.7806
TI - Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction
T2 - Mendeleev Communications
AU - Kostyukovich, Alexander Yu
AU - Shutovskaya, Evgeniya S.
AU - Prima, Darya Olegovna
PY - 2025
DA - 2025/11/29
PB - Mendeleev Communications
SP - 37-40
IS - 1
VL - 36
ER -
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@article{2025_Kostyukovich,
author = {Alexander Yu Kostyukovich and Evgeniya S. Shutovskaya and Darya Olegovna Prima},
title = {Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction},
journal = {Mendeleev Communications},
year = {2025},
volume = {36},
publisher = {Mendeleev Communications},
month = {Nov},
url = {https://mendcomm.colab.ws/publications/10.71267/mencom.7806},
number = {1},
pages = {37--40},
doi = {10.71267/mencom.7806}
}
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Kostyukovich, Alexander Yu., et al. “Influence of N-heterocyclic carbene modification on the catalytic performance of Pd clusters and nanoparticles in the Mizoroki--Heck reaction.” Mendeleev Communications, vol. 36, no. 1, Nov. 2025, pp. 37-40. https://mendcomm.colab.ws/publications/10.71267/mencom.7806.
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Keywords

DFT calculations.
Mizoroki�Heck reaction
modified nanoparticles
palladium catalysis
palladium clusters
Reaction mechanism

Abstract

The addition of azolium salt as N-heterocyclic carbene (NHC) proligant improved the catalytic performance of palladium nanoparticles in the Mizoroki-Heck coupling. The catalytic activity of NHC-modified palladium on carbon (Pd-NHC/C) was evaluated in reactions involving a variety of olefin and aryl bromide counterparts. Quantum chemical calculations of the full reaction pathways for both ligand-free and NHC-modified Pd2 clusters revealed a reduction in the activation energy of the second reaction route.

Funders

Russian Science Foundation
22-73-10109

References

1.
Encapsulated Metal Nanoparticles for Catalysis
Gao C., Lyu F., Yin Y.
Chemical Reviews, 2020
2.
Kuznetsova S.A., Yunusov S.M., Khakina E.A., Naumkin A.V., Chusov D.A., Kalyuzhnaya E.S., Ilyin M.M., Morozov V.V., Kashin A.S., Belokon Y.N.
Mendeleev Communications, 2024
3.
Bridging the Gap from Mononuclear PdII Precatalysts to Pd Nanoparticles: Identification of Intermediate Linear [Pd3(XPh3)4]2+ Clusters as Catalytic Species for Suzuki–Miyaura Couplings (X = P, As)
Appleby K.M., Dzotsi E., Scott N.W., Dexin G., Jeddi N., Whitwood A.C., Pridmore N.E., Hart S., Duckett S.B., Fairlamb I.J.
Organometallics, 2021
5.
N-Heterocyclic carbenes as tunable ligands for catalytic metal surfaces
Koy M., Bellotti P., Das M., Glorius F.
Nature Catalysis, 2021
6.
N-Heterocyclic Carbenes in Materials Chemistry
Smith C.A., Narouz M.R., Lummis P.A., Singh I., Nazemi A., Li C., Crudden C.M.
Chemical Reviews, 2019
9.
In situ transformations of Pd/NHC complexes with N-heterocyclic carbene ligands of different nature into colloidal Pd nanoparticles
Kostyukovich A.Y., Tsedilin A.M., Sushchenko E.D., Eremin D.B., Kashin A.S., Topchiy M.A., Asachenko A.F., Nechaev M.S., Ananikov V.P.
Inorganic Chemistry Frontiers, 2019
13.
Revealing the mechanism of combining best properties of homogeneous and heterogeneous catalysis in hybrid Pd/NHC systems
Prima D., Kulikovskaya N., Novikov R., Kostyukovich A., Burykina J., Chernyshev V., Ananikov V.P.
Angewandte Chemie - International Edition, 2024
16.
Modular Bidentate Hybrid NHC-Thioether Ligands for the Stabilization of Palladium Nanoparticles in Various Solvents
Rühling A., Schaepe K., Rakers L., Vonhören B., Tegeder P., Ravoo B.J., Glorius F.
Angewandte Chemie - International Edition, 2016
18.
Nanoclusters in Ionic Liquids:  Evidence for N-Heterocyclic Carbene Formation from Imidazolium-Based Ionic Liquids Detected by 2H NMR
Ott L.S., Cline M.L., Deetlefs M., Seddon K.R., Finke R.G.
Journal of the American Chemical Society, 2005
20.
Heck, Sonogashira, and Hiyama Reactions Catalyzed by Palladium Nanoparticles Stabilized by Tris-Imidazolium Salt
Planellas M., Moglie Y., Alonso F., Yus M., Pleixats R., Shafir A.
European Journal of Organic Chemistry, 2014
21.
Molecular Adsorbates Switch on Heterogeneous Catalysis: Induction of Reactivity by N-Heterocyclic Carbenes
Ernst J.B., Schwermann C., Yokota G., Tada M., Muratsugu S., Doltsinis N.L., Glorius F.
Journal of the American Chemical Society, 2017
22.
Metal vapor synthesis of ultrasmall Pd nanoparticles functionalized with N-heterocyclic carbenes
Tegeder P., Marelli M., Freitag M., Polito L., Lamping S., Psaro R., Glorius F., Ravoo B.J., Evangelisti C.
Dalton Transactions, 2018