THEORETICAL STUDY ON 15-CROWN-5 COMPLEX WITH SOME METAL CATIONS
The capability of 15-crown-5 ethers to form complexes with some metal cations (Li+, Na+, K+, Zn2+, Cd2+ and Hg2+) was investigated by an ab initio quantum mechanical method. The calculations were performed at the RHF/lanl2mb level of theory. The interaction energies were used to evaluate the metal b...
Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
Department of Chemistry, Universitas Gadjah Mada
2012-06-01
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Series: | Indonesian Journal of Chemistry |
Subjects: | |
Online Access: | https://jurnal.ugm.ac.id/ijc/article/view/21353 |