Structure elucidation, DFT and IRI computational investigations of a novel 4-(3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl) 2, 6-dimethyl-1, 4-dihydropyridine-3, 5 …

NR Sreenatha, TNM Prasad, MH Kumar… - Journal of Molecular …, 2024 - Elsevier
A novel symmetric dihydropyridine possessing cyano group at C11 and C14 has been
synthesized using a modified Hantzsch method. The compound (Image 1) was …

Comprehensive analysis of polyethylene glycol–lauric acid as a promising phase change material: Spectroscopic, thermal, and quantum insights

K Husniatul, D Cui, H Lu, X Xu, Z Men, S Wang… - Journal of Molecular …, 2024 - Elsevier
The increasing need for effective and environmentally sustainable energy storage
technologies has delineated phase change materials (PCMs) as prospective candidates for …

Synthesis, structural and computational studies of a novel anionic synthon and its derivatives

S HariPrasad, NR Sreenatha, B Suchithra… - Journal of Molecular …, 2023 - Elsevier
A novel trimethylsilyl anionic synthon: 9-(4'-trimethylsilyl-1', 2', 3'-triazol-1'-yl)
methylanthracene was synthesized by copper catalyzed reaction of 9 …