Research output: Contribution to journal › Article › peer-review
Why [2 + 2]-cycloaddition reactions between isocyanates and imines do not occur in Pd-activation conditions? / Novikov, Alexander S.
In: Inorganica Chimica Acta, Vol. 510, 119758, 24.09.2020.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Why [2 + 2]-cycloaddition reactions between isocyanates and imines do not occur in Pd-activation conditions?
AU - Novikov, Alexander S.
PY - 2020/9/24
Y1 - 2020/9/24
N2 - Over the course of the spontaneous decomposition of Pd-bound oxadiazoline N-heterocyclic carbenes, the reaction system includes four types of species (free and coordinated isocyanates, free and coordinated imines) and can be assumed the possibility of the formation of various types of four-membered heterocycles via [2 + 2]-cycloaddition. However, has not been detected the formation of any such structures. This theoretical study focuses on the reasons why in Pd-activation conditions isocyanates and imines do not react with each other.
AB - Over the course of the spontaneous decomposition of Pd-bound oxadiazoline N-heterocyclic carbenes, the reaction system includes four types of species (free and coordinated isocyanates, free and coordinated imines) and can be assumed the possibility of the formation of various types of four-membered heterocycles via [2 + 2]-cycloaddition. However, has not been detected the formation of any such structures. This theoretical study focuses on the reasons why in Pd-activation conditions isocyanates and imines do not react with each other.
KW - Aza-β-lactams
KW - Cycloaddition
KW - DFT
KW - Imines
KW - Isocyanates
KW - 1,3-DIPOLAR CYCLOADDITIONS
KW - KETENES
KW - ACID
KW - MECHANISM
KW - NITRONES
KW - STEREOCONTROL
KW - AB-INITIO
KW - REACTIVITY
KW - INPLANE AROMATICITY
KW - AZA-BETA-LACTAMS
UR - http://www.scopus.com/inward/record.url?scp=85085291712&partnerID=8YFLogxK
U2 - 10.1016/j.ica.2020.119758
DO - 10.1016/j.ica.2020.119758
M3 - Article
AN - SCOPUS:85085291712
VL - 510
JO - Inorganica Chimica Acta
JF - Inorganica Chimica Acta
SN - 0020-1693
M1 - 119758
ER -
ID: 60213941