CiteScore: 5.0     h-index: 22

Synthesis, Antibacterial, Antifungal and DFT Studies on Structural, Electronic and Chemical Reactivity of (E)-7-((1H-Indol-3-yl)methylene)-1,2,6,7-tetrahydro-8H-indeno[5,4-b]furan-8-one
Synthesis, Antibacterial, Antifungal and DFT Studies on Structural, Electronic and Chemical Reactivity of (E)-7-((1H-Indol-3-yl)methylene)-1,2,6,7-tetrahydro-8H-indeno[5,4-b]furan-8-one

Vishnu Ashok Adole

Volume 4, Issue 3 , May and June 2021, , Pages 175-187

https://doi.org/10.22034/ajca.2021.278047.1250

Abstract
  The present study deals with the theoretical investigation of structural, molecular, electronic, and chemical reactivity details of (E)-7-((1H-indol-3-yl)methylene)-1,2,6,7-tetrahydro-8H-indeno[5,4-b]furan-8-one ...  Read More
Molecular Structure, FT-IR Spectra, MEP and HOMO-LUMO Investigation of 2-(4-Fluorophenyl)-5-phenyl-1, 3,4-oxadiazole Using DFT Theory Calculations
Molecular Structure, FT-IR Spectra, MEP and HOMO-LUMO Investigation of 2-(4-Fluorophenyl)-5-phenyl-1, 3,4-oxadiazole Using DFT Theory Calculations

Sunil Laxman Dhonnar; Nutan Vitthal Sadgir; Vishnu Ashok Adole; Bapu Sonu Jagdale

Volume 4, Issue 3 , May and June 2021, , Pages 220-230

https://doi.org/10.22034/ajca.2021.283003.1254

Abstract
  In the present work, synthesis and DFT study of 2-(4-fluorophenyl)-5-phenyl-1,3,4-oxadiazole is reported. The 6-311++G (d,p) basis set was used to optimize the molecular structure of ...  Read More