Application of the MNDO method in planning the synthesis of Δ2-1,2,3-triazoles

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Title:Application of the MNDO method in planning the synthesis of Δ2-1,2,3-triazoles
Creators:
Juranić, Ivan
Husinec, Suren
Savić, Vladimir
Porter, Alexander E. A.
Journal or Publication Title:
Collection of Czechoslovak Chemical Communications, 56, 2, pp. 411-417

Abstract

A study on the reactivity of several azides and dipolarophiles in [3 + 2]cycloaddition reaction has been carried out and the results analyzed by MNDO calculations. In all cases it can be demonstrated that the reactivity is dependent not on the energy difference between the HOMO of one reactant and LUMO of the other but on the energy difference of corresponding chemically significant Mos.

Title:Application of the MNDO method in planning the synthesis of Δ2-1,2,3-triazoles
Creators:
Juranić, Ivan
Husinec, Suren
Savić, Vladimir
Porter, Alexander E. A.
Divisions:Life and Chemical Sciences > Institute of Organic Chemistry and Biochemistry > Collection of Czechoslovak Chemical Communications
Journal or Publication Title:Collection of Czechoslovak Chemical Communications
Volume:56
Number:2
Page Range:pp. 411-417
ISSN:0010-0765
E-ISSN:1212-6950
Publisher:Institute of Organic Chemistry and Biochemistry
Related URLs:
URLURL Type
http://dx.doi.org/10.1135/cccc19910411UNSPECIFIED
ID Code:4960
Item Type:Article
Deposited On:22 Feb 2010 11:27
Last Modified:22 Feb 2010 10:27

Citation

Juranić, Ivan; Husinec, Suren; Savić, Vladimir; Porter, Alexander E. A. (1991) Application of the MNDO method in planning the synthesis of Δ2-1,2,3-triazoles. Collection of Czechoslovak Chemical Communications, 56 (2). pp. 411-417. ISSN 0010-0765

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