Structural, Conformational and Spectroscopic Properties of C16H16BrNO3 Schiff-Base Molecule: A Theoretical Investigation
The Schiff- bases compound C16H16BrNO3molecular geometry, vibrational frequencies and electronic properties(total energy, dipole moment,electronegativity, chemical hardness and softness) were investigated usingDFT(B3LYP) method. Besides, the conformational analysis was made with respectto selected d...
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| Format: | Article |
| Language: | English |
| Published: |
Sakarya University
2018-12-01
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| Series: | Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi |
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| Online Access: | https://dergipark.org.tr/tr/download/article-file/444901 |
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