AM1 study of the thermolysis of acetone cyclic diperoxide

The thermolysis of acetone cyclic diperoxide has been investigated by the AM1 MO method using the unrestricted Hartree-Fock (UHF) approach. This thermal decomposition takes place by two routes with activation energies of 130 and 152 kJ mol −1.

Saved in:
Bibliographic Details
Published inJournal of molecular structure. Theochem Vol. 363; no. 3; pp. 339 - 342
Main Authors San-Guo, Hong, Youg-Hong, Li
Format Journal Article
LanguageEnglish
Published Elsevier B.V 22.04.1996
Subjects
Acetone cyclic diperoxide
AM1 method
Thermolysis
Acetone cyclic diperoxide
AM1 method
Thermolysis
Online AccessGet full text

Cover

More Information
Summary:The thermolysis of acetone cyclic diperoxide has been investigated by the AM1 MO method using the unrestricted Hartree-Fock (UHF) approach. This thermal decomposition takes place by two routes with activation energies of 130 and 152 kJ mol −1.
ISSN:0166-1280
1872-7999
DOI:10.1016/0166-1280(95)04419-1