T Lu, S Manzetti - Structural Chemistry, 2014 - Springer
Benzo [a] pyrene is a known carcinogen, which derives from fossil fuel combustion, cigarette smoke, and generic biomass combustion including traffic emissions. This potent carcinogen …
KP Manoj, N Elangovan, S Chandrasekar - Inorganic Chemistry …, 2022 - Elsevier
The di (p-methyl benzyl)(dibromo)(1, 10-phenanthroline) tin (IV) complex (M2) was synthesized and experimentally proved by FT-IR, FT-Raman, 1 HNMR, 13 CNMR, 119 …
The electrophilic/nucleophilic character of a series of captodative (CD) ethylenes involved in polar cycloaddition reactions has been studied using DFT methods at the B3LYP/6-31G (d) …
A new Schiff base (E) 2-hydroxy-5-(((4-(N-pyrimidin-2-yl) sulfamoyl) phenyl) imino) methyl benzoic acid (5FSADA) compound was synthesized by condensation of 5-formyl salicylic …
By analyzing structural and electronic properties of more than a hundred predicted hydrogen- based superconductors, we determine that the capacity of creating an electronic bonding …
A new Schiff base (E)-4-((4-bromobenzylidene) amino) benzenesulfonamide (M2) was synthesized by the reaction between 4-bromobenzaldehyde and sulfanilamide followed by …
N Elangovan, S Sowrirajan - Heliyon, 2021 - cell.com
Abstract The Schiff base (E)-4-((2-hydroxy-3, 5-diiodobenzylidene) amino)-N-(pyrimidine)-2- yl) benzene sulfonamide (DIDA) compound was synthesis with condensation of 3, 5 …
Computational materials discovery efforts utilize hundreds or thousands of density functional theory calculations to predict material properties. Historically, such efforts have performed …
S Sowrirajan, N Elangovan, G Ajithkumar… - Journal of Molecular …, 2022 - Elsevier
Abstract Infrared, Raman, 1HNMR, 13CNMR, and VU-Visible spectroscopy have been used to characterize the newly synthesized compound (E)-4-((perfluorophenyl) methylene) …