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Quantum chemical insight into molecular structure, NBO anal..:
Mary, S.J. Jenepha
;
Siddique, Mohd Usman Mohd
;
Pradhan, Sayantan
..
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. 244 (2021) - p. 118825 , 2021
Link:
https://doi.org/10.1016/j.saa.2020.118825
RT Journal T1
Quantum chemical insight into molecular structure, NBO analysis of the hydrogen-bonded interactions, spectroscopic (FT–IR, FT–Raman), drug likeness and molecular docking of the novel anti COVID-19 molecule 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide - dimer
UL https://suche.suub.uni-bremen.de/peid=cr-10.1016_j.saa.2020.118825&Exemplar=1&LAN=DE A1 Mary, S.J. Jenepha A1 Siddique, Mohd Usman Mohd A1 Pradhan, Sayantan A1 Jayaprakash, Venkatesan A1 James, C. PB Elsevier BV YR 2021 SN 1386-1425 JF Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy VO 244 SP 118825 LK http://dx.doi.org/https://doi.org/10.1016/j.saa.2020.118825 DO https://doi.org/10.1016/j.saa.2020.118825 SF ELIB - SuUB Bremen
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