Synthesis, molecular structure, Hirshfeld surface, spectral investigations and molecular docking study of 3-(5-bromo-2-thienyl)-1-(4-fluorophenyl)-3-acetyl-2-pyrazoline (2) by DFT method
The 3-(5-Bromo-2-thienyl)-1-(4-fluorophenyl)-3-acetyl-2-pyrazoline (2) (BTFA) was synthesized from condensation of thiophenechalcone (1) and hydrazine hydrate. The compound was characterized by FT-IR, 1H and 13C NMR. Crystal structure of this compound was determined using X-ray diffraction technique...
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| Main Authors: | , , , , , , , , |
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| Format: | Article |
| Published: |
Elsevier B.V.
2018
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| Subjects: | |
| Online Access: | http://eprints.utm.my/id/eprint/85605/ http://dx.doi.org/10.1016/j.molstruc.2018.03.004 |
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