Modeling and synthesis of bifunctional dual activation thiourea organocatalysts for Michael addition of pyrazole
Modeling of Michael addition of pyrazole to cinnamaldehyde in the presence of six thiourea catalysts has been done at the DFT (B3LYP/6-31+G(d,p)) level. Four catalysts incorporating 2-pyridyl moiety are found to exhibit bifunctional dual activation by encapsulating pyrazole molecule in the cavity of...
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| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2025-12-01
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| Series: | Tetrahedron Green Chem |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2773223125000202 |
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