Investigation of Huisgen's Noble metal catalyst click reaction mechanism for the synthesis of 1, 4-disubstituted 1, 2, 3-triazoles
AA Khairbek, MI Al-Zaben, R Puchta, MAAH Badawi… - Molecular …, 2024 - Elsevier
The current study delves into the mechanistic intricacies of azide-alkyne cycloaddition
reactions (MAAC) catalyzed by transition metals (M= Cu, Ag, and Au) bound to N …
reactions (MAAC) catalyzed by transition metals (M= Cu, Ag, and Au) bound to N …
Assessing the catalytic potential of novel halogen substituted carbene NHC (F, Cl, Br, I) catalysts in [3+ 2] cycloaddition reactions: A computational investigation
This study investigated the catalytic behavior of NHC-X ligands (X= F, Cl, Br, I) in
cycloaddition reactions, focusing on both mononuclear and binuclear pathways. Using NCI …
cycloaddition reactions, focusing on both mononuclear and binuclear pathways. Using NCI …
Elucidating the mechanism and regioselectivity of phosphine-catalyzed transformation of MBH carbonate
J Ye, Y Luo, G Huang, Y Wang - New Journal of Chemistry, 2023 - pubs.rsc.org
The detailed mechanism and the role of catalyst in the PPh3-catalyzed [3+ 6] annulation
reaction of MBH carbonate and dicyanoheptafulvene have been systematically investigated …
reaction of MBH carbonate and dicyanoheptafulvene have been systematically investigated …
Exploring the potential of metal-catalysis with N, N-type ligands in [3+ 2] cycloaddition reactions of azides and alkynes using theoretical tools
AA Khairbek, MI Al-Zaben, F Abbas… - Reaction Kinetics …, 2024 - Springer
In this study, we meticulously analyzed the catalysis of azide-alkyne [3+ 2] cycloaddition
reactions facilitated by metal-complexes with N, N-type ligands using MN12-L functional with …
reactions facilitated by metal-complexes with N, N-type ligands using MN12-L functional with …
Computational studies on CuAAC reaction mechanism with [CuX (PPh3)]; X= I, Br, Cl for the synthesis of 4-and 5-halo-1, 2, 3-triazoles
A complementary catalytic system was investigated for the [3+ 2] cycloaddition of azides and
halo-alkynes. These are based on three copper complexes with [CuX (PPh3)]; X= I, Br, Cl …
halo-alkynes. These are based on three copper complexes with [CuX (PPh3)]; X= I, Br, Cl …
Electron-withdrawing effect of polyoxometalates in Cu (I)-based metal–organic frameworks for enhanced azide-alkyne “click” reaction
BB Lu, JQ Guan, YT Wu, SY An, Y Fu, F Ye - Journal of Catalysis, 2024 - Elsevier
Boosting the nucleophilicity of Cu (I) sites is an essential strategy to enhance the efficiency
of Cu (I)-catalyzed azide-alkyne cycloaddition (CuAAC) reaction. In this work, a Lindquist …
of Cu (I)-catalyzed azide-alkyne cycloaddition (CuAAC) reaction. In this work, a Lindquist …
Silver-and gold-catalyzed azide− alkyne cycloaddition by functionalized NHC-based polynuclear catalysts: Computational investigation and mechanistic insights
This study evaluated the catalytic efficiency of Au (I), Ag (I), and Cu (I) complexes in the
azide‒alkyne cycloaddition (AAC) reaction through density functional theory (DFT) …
azide‒alkyne cycloaddition (AAC) reaction through density functional theory (DFT) …
Theoretical Study on Cooperation Catalysis of Chiral Guanidine/Copper (I) in Asymmetric Azide–Alkyne Cycloaddition/[2+ 2] Cascade Reaction
Q Wei, Y Zhang, C Lv, C Hu, Z Su - The Journal of Organic …, 2023 - ACS Publications
Density functional theory (DFT) calculations with BP86-D3 (BJ) functionals were employed
to reveal the mechanism and stereoselectivity of chiral guanidine/copper (I) salt-catalyzed …
to reveal the mechanism and stereoselectivity of chiral guanidine/copper (I) salt-catalyzed …
Unveiling the ion sensing capabailities of 'click'derived chalcone-tailored 1, 2, 3-triazolic isomers for Pb (ii) and Cu (ii) ions: DFT analysis
R Singh, G Singh, N George, G Singh, P Malik… - RSC …, 2024 - pubs.rsc.org
In this study, two novel chalcone-derived 1, 2, 3-triazole-appended positional isomers
(probe 6 and probe 9) were synthesized via the 'CuAAC'(Cu (I)–catalysed alkyne azide …
(probe 6 and probe 9) were synthesized via the 'CuAAC'(Cu (I)–catalysed alkyne azide …
Ultrafine low loading AgCu nanoclusters supported on defective ZIF-8 for the click reaction with high stability
X Li, S Ajmal, P Fang, X Zhou, M Lu, S Li… - New Journal of …, 2024 - pubs.rsc.org
Ultrafine metal nanoclusters have been extensively studied due to their fascinating chemical
characteristics. In this work, ultrafine AgCu nanoclusters are synthesized and loaded on the …
characteristics. In this work, ultrafine AgCu nanoclusters are synthesized and loaded on the …