Theoretical Study of 1,3-Dipolar Cycloaddition Reaction of Aryl Azide and its Derivatives with Cinnamic Acid one in Gas State and with Different Solvents
The 1,3-dipolar cycloaddition of the aryl azide and some its of derivatives with cinnamic acid was studied theoretically using different methods of Density Functional Theory (DFT): B3LYP, B3PW91, MPW1PBE, MPW1PW91 and M062X with the basic set 6-31g(d). Most of the used levels of theories provi...
| Main Authors: | , |
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| Format: | Article |
| Language: | Arabic |
| Published: |
Tishreen University
2018-11-01
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| Series: | مجلة جامعة تشرين للبحوث والدراسات العلمية، سلسلة العلوم الأساسية |
| Online Access: | http://journal.tishreen.edu.sy/index.php/bassnc/article/view/4587 |