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Polycyclic Aromatic Compounds Volume 43, 2023 - Issue 3
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Research Articles

Barrier Potential, Structure (Monomer and Dimer), Inter- and Intra-Molecular Interactions, Vibrational Analysis, Fukui Functions, MESP, NBO, UV and NMR Analysis of Pyridine-3-Carboxylic Acid Using Spectroscopic and DFT Approach

G. Ramesha Department of Physics, University P.G College (Satavahana University), Godavarikhani, Telangana, India
&
B. Venkatram Reddyb Department of Physics, Kakatiya University, Warangal, Telangana, IndiaCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0001-6516-7731
ORCID Icon
Pages 2488-2505 | Received 18 Jan 2022, Accepted 17 Feb 2022, Published online: 14 Mar 2022

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L. Ravindranath, K. Srishailam & B. Venkatram Reddy. (2023) Experimental and DFT Quantum Chemical Studies on Structural, Vibrational and Molecular Properties of Some Substituted 4-Phenylphenols. Polycyclic Aromatic Compounds 43:10, pages 9233-9268.
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Articles from other publishers (1)

Mehmet BAĞLAN, Kenan GÖREN & Ümit YILDIKO. (2023) DFT Computations and Molecular Docking Studies of 3-(6-(3-aminophenyl)thiazolo[1,2,4]triazol-2-yl)-2H-chromen-2-one(ATTC) Molecule. Hittite Journal of Science and Engineering 10:1, pages 11-19.
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