Theoretical study of polar 2 + 2 cycloadditions

Miguel Durán; Juan Bertrán

Theoretical study of polar 2 + 2 cycloadditions

Miguel Durán, Juan Bertrán

Departament de Química

Producció científica: Contribució a revista › Article › Recerca › Avaluat per experts

9 Cites (Scopus)

Resum

By means of the MINDO/3 method the polar 2 + 2 cycloaddition of hydroxyethylene to 1,1-dicyanoethylene and the dimerization of ethylene have been studied. For the polar reaction the transition state has dipolar character, while for the non-polar reaction it has a tricentric structure. The reaction mechanism and the importance of charge transfer are discussed.

Idioma original	Anglès
Pàgines (de-a)	681-685
Revista	Journal of the Chemical Society, Perkin Transactions 2 (2001)
Número	6
Estat de la publicació	Publicada - 1 de des. 1982

Altres arxius i enllaços

https://www.scopus.com/pages/publications/37049103004

Com citar-ho

@article{268087f3f90345e383eb4d6b0ea10302,

title = "Theoretical study of polar 2 + 2 cycloadditions",

abstract = "By means of the MINDO/3 method the polar 2 + 2 cycloaddition of hydroxyethylene to 1,1-dicyanoethylene and the dimerization of ethylene have been studied. For the polar reaction the transition state has dipolar character, while for the non-polar reaction it has a tricentric structure. The reaction mechanism and the importance of charge transfer are discussed.",

author = "Miguel Dur{\'a}n and Juan Bertr{\'a}n",

year = "1982",

month = dec,

day = "1",

language = "English",

pages = "681--685",

number = "6",

}

TY - JOUR

T1 - Theoretical study of polar 2 + 2 cycloadditions

AU - Durán, Miguel

AU - Bertrán, Juan

PY - 1982/12/1

Y1 - 1982/12/1

N2 - By means of the MINDO/3 method the polar 2 + 2 cycloaddition of hydroxyethylene to 1,1-dicyanoethylene and the dimerization of ethylene have been studied. For the polar reaction the transition state has dipolar character, while for the non-polar reaction it has a tricentric structure. The reaction mechanism and the importance of charge transfer are discussed.

AB - By means of the MINDO/3 method the polar 2 + 2 cycloaddition of hydroxyethylene to 1,1-dicyanoethylene and the dimerization of ethylene have been studied. For the polar reaction the transition state has dipolar character, while for the non-polar reaction it has a tricentric structure. The reaction mechanism and the importance of charge transfer are discussed.

UR - https://www.scopus.com/pages/publications/37049103004

M3 - Article

SN - 1472-779X

SP - 681

EP - 685

JO - Journal of the Chemical Society, Perkin Transactions 2 (2001)

JF - Journal of the Chemical Society, Perkin Transactions 2 (2001)

IS - 6

ER -

Theoretical study of polar 2 + 2 cycloadditions

Resum

Altres arxius i enllaços

Fingerprint

Com citar-ho