Exploring the Mechanism of the Intramolecular Diels–Alder Reaction of (2<i>E</i>,4<i>Z</i>,6<i>Z</i>)-2(allyloxy)cycloocta-2,4,6-trien-1-one Using Bonding Evolution Theory
In the present work, the bond breaking/forming events along the intramolecular Diels–Alder (IMDA) reaction of (2<i>E</i>,4<i>Z</i>,6<i>Z</i>)-2(allyloxy)cycloocta-2,4,6-trien-1-one have been revealed within bonding evolution theory (BET) at the density functional theory level, using the M05-2X funct...
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| Автори: | , , , , , , |
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| Формат: | Artigo |
| Мова: | Inglês |
| Опубліковано: |
MDPI AG
2023-09-01
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| Серія: | Molecules |
| Предмети: | |
| Онлайн доступ: | https://www.mdpi.com/1420-3049/28/19/6755 |
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