An ab Initio Study on the Allene−Isocyanic Acid and Ketene−Vinylimine [2 + 2] Cycloaddition Reaction Paths

2006 ◽  
Vol 110 (10) ◽  
pp. 3723-3737 ◽  
Author(s):  
Joanna E. Rode ◽  
Jan Cz. Dobrowolski
Keyword(s):  
Ab Initio ◽  
Cycloaddition Reaction ◽  
Isocyanic Acid ◽  
Ab Initio Study ◽  
Reaction Paths

scholarly journals An ab initio study of the mechanism of the cycloaddition reaction forming bicyclic compounds between vinylidene (H2C=C:) and ethylene

2011 ◽  
Vol 76 (5) ◽  
pp. 743-749 ◽  
Author(s):  
Xiuhui Lu ◽  
Zhenxia Lian ◽  
Li Yongqing
Keyword(s):  
Ab Initio ◽  
Cycloaddition Reaction ◽  
Ab Initio Study ◽  
Bicyclic Compounds

The mechanism of the cycloaddition reaction forming a bicyclic compounds between singlet vinylidene (H2C=C:) and ethylene was investigated using the CCSD(T)//MP2/6-31G

Ab initio Study of Mechanism of Cycloaddition Reaction between Germylene Silylene (H2GeSi:) and Acetone

2011 ◽  
Vol 29 (9) ◽  
pp. 1969-1974 ◽  
Author(s):  
Xiuhui Lu ◽  
Junfeng Han ◽  
Yongqing Li ◽  
Zhina Wang
Keyword(s):  
Ab Initio ◽  
Cycloaddition Reaction ◽  
Ab Initio Study

Ab initio study on the mechanism of cycloaddition reaction between H2Si=Si: and formaldehyde

2011 ◽  
Vol 22 (4) ◽  
pp. 857-864 ◽  
Author(s):  
Xiuhui Lu ◽  
Leyi Shi ◽  
Zhenxia Lian ◽  
Yongqing Li
Keyword(s):  
Ab Initio ◽  
Cycloaddition Reaction ◽  
Ab Initio Study

An ab initio study on the mechanism of the alkene–isocyanate cycloaddition reaction to form β-lactams

1993 ◽  
pp. 1450-1452 ◽  
Author(s):  
Fernando P. Cossío ◽  
Begoña Lecea ◽  
Xabier Lopez ◽  
Guillermo Roa ◽  
Ana Arrieta ◽  
...  
Keyword(s):  
Ab Initio ◽  
Cycloaddition Reaction ◽  
Ab Initio Study

Ab initio study of the ammonia ion–ammonia reaction paths

1996 ◽  
Vol 104 (11) ◽  
pp. 4049-4054 ◽  
Author(s):  
Nadia Ben Amor ◽  
Daniel Maynau ◽  
Fernand Spiegelmann
Keyword(s):  
Ab Initio ◽  
Ab Initio Study ◽  
Reaction Paths
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