DFT, molecular docking and experimental FT-IR, FT-Raman, NMR inquisitions on “4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methylpyrimidin-5-amine”: Alpha-2-imidazoline receptor agonist antihypertensive agent

Published 2019 View Full Article

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Title
DFT, molecular docking and experimental FT-IR, FT-Raman, NMR inquisitions on “4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methylpyrimidin-5-amine”: Alpha-2-imidazoline receptor agonist antihypertensive agent
Authors
Keywords
DFT, FT-IR, FT-Raman, NBO, HOMO-LUMO, Fukui functions
Journal
JOURNAL OF MOLECULAR STRUCTURE
Volume 1186, Issue -, Pages 468-481
Publisher
Elsevier BV
Online
2019-03-19
DOI
10.1016/j.molstruc.2019.03.056

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