Quantum Chemical Modeling of 1-(1, 3-Benzothiazol-2-yl)-3-(thiophene-5-carbonyl) thiourea: Molecular structure, NMR, FMO, MEP and NBO analysis based on DFT calculations
Subject Areas : Journal of Physical & Theoretical Chemistry
Masoome Sheikhi
1
(Iran, Islamic azad university)
Siyamak Shahab
2
(Institute of Physical Organic Chemistry, National Academy of Sciences of Belarus,13 Surganov Str, Minsk 220072, Belarus)
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