Litcius/Paper detail

Crystal structure, DFT studies, Hirshfeld surface and energy framework analysis of 4-(5-nitro-thiophen-2-yl)-pyrrolo [1, 2-a] quinoxaline: A potential SARS-CoV-2 main protease inhibitor

K. Divya, D.P. Savitha, G. Anjali Krishna, T.M. Dhanya, P. V. Mohanan

2021Journal of Molecular Structure23 citationsDOIOpen Access PDF

Topics & Concepts

ChemistryMonoclinic crystal systemQuinoxalineCrystallographyCrystal structureDensity functional theorySingle crystalIntermolecular forceComputational chemistryMoleculeOrganic chemistrySynthesis and biological activitySynthesis and Biological EvaluationSynthesis and Characterization of Heterocyclic Compounds
Crystal structure, DFT studies, Hirshfeld surface and energy framework analysis of 4-(5-nitro-thiophen-2-yl)-pyrrolo [1, 2-a] quinoxaline: A potential SARS-CoV-2 main protease inhibitor | Litcius