Correlation models in the studies of structure and properties of amides
The structures of the row of amides of saturated hydrocarbons were investigated. The amides of C1-C5 row were investigated. The equilibrium geometries of molecules were identified. The total electronic energies were computed at SCF, MP2 and PM3 levels of theory. The enthalpies of formation were comp...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
al-Farabi Kazakh National University
2012-05-01
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| Series: | Chemical Bulletin of Kazakh National University |
| Subjects: | |
| Online Access: | https://bulletin.chemistry.kz/index.php/kaznu/article/view/265 |