Funder
Fundação para a Ciência e a Tecnologia
QREN-COMPETE-UE
Subject
Spectroscopy,Instrumentation,Atomic and Molecular Physics, and Optics,Analytical Chemistry
Cited by
13 articles.
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1. Synthesis, Characterization, Hirshfeld Surface Analysis, DFT Study and Molecular Docking of 1,3‐Bis(4‐chlorophenyl)‐ 5‐(4‐chlorobenzyl)‐1,3,5‐triazinane;ChemistrySelect;2023-11-05
2. Computed Vibrational Spectra and Structure of the Extraterrestrial Meteoritic Iron-Bearing Cyano-Carbonyl Complex [FeII(CN)4(CO)2]2–;ACS Earth and Space Chemistry;2023-10-05
3. Molecular structure, HOMO-LUMO, MEP - – Analysis of triazine compounds using DFT (B3LYP) calculations;Materials Today: Proceedings;2023-10
4. Calculations of Absolute Solvation Free Energies with Transformato─Application to the FreeSolv Database Using the CGenFF Force Field;Journal of Chemical Theory and Computation;2023-08-24
5. Structural and Spectral Studies of Bis (1, 3, 5-triazinane-2, 4, 6-trione) 1, 4-diazabicyclo [2·2·2] Octane (TTDO).;Journal of Chemical Crystallography;2023-08-17