Structure and Electronic Properties of Aminopyridino-1-4-[chi]-2-methoxycyclohexa-1,3-diene Irontricarbonyl Complexes - A Semi Empirical PM3 Approach

Herein, the authors report the theoretical studies of aminopyridino-1-4-η-2-methoxycyclohexa-1,3-diene irontricarbonyl complexes. The theoretical ground state geometries, electronic, thermodynamic properties and vibrational frequencies were obtained using Semi-empirical PM3 method. The geometries, e...

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Bibliographic Details
Published inAsian Journal of Research in Chemistry Vol. 6; no. 11; p. 4
Main Authors Adejoro, I A, Odiaka, T I, Akinyele, O F
Format Journal Article
LanguageEnglish
Published Raipur A&V Publications 01.11.2013
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Summary:Herein, the authors report the theoretical studies of aminopyridino-1-4-η-2-methoxycyclohexa-1,3-diene irontricarbonyl complexes. The theoretical ground state geometries, electronic, thermodynamic properties and vibrational frequencies were obtained using Semi-empirical PM3 method. The geometries, electronic states, thermodynamic properties and vibrational frequencies are reported and discussed.
ISSN:0974-4169
0974-4150