Computational, Hirshfeld surface, and molecular docking analysis of 2-(((4-methoxyphenyl)imino)methyl)-4-nitrophenol: In-vitro anticancer, antimicrobial, anti-inflammatory, and antioxidant studies
A Schiff base, 2-(((4-methoxyphenyl) imino) methyl)-4-nitrophenol (1) was synthesized with high yield. We have focused on its computational investigation using density functional theory (DFT) approach with B3LYP/6-311G+(d,p) level and in-vitro pharmacological, antioxidant activity, and molecular doc...
| Main Authors: | , , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2022-01-01
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| Series: | Results in Chemistry |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2211715622000509 |