Theoretical Study of Quinoline Aza Oxa Thia 17-Crown -6 Complexes: NICS Aromaticity
Complexation of quinoline aza oxa this 17-crown-6 (L) with some metal cations (K+, Na+, Li+, Mg2+) was studied through computational methods. Hartree-Fock method was employed to identify structure and thermodynamical binding constant of crown and metal ions complexes. The calculations were conducte...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
PURKH
2019-12-01
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| Series: | To Chemistry Journal |
| Subjects: | |
| Online Access: | https://purkh.com/index.php/tochem/article/view/559 |