Articles

type: Journal
Title DOI Date
Theoretical studies on tautomerism of triazole derivatives in the gas phase and solution #
Experimental and CIS TD-DFT ab initio calculations of visible spectra and the vibrational frequencies of sulfonyl azide-azoic dyes #
Rapid and efficient diazotization and diazo coupling reactions on silica sulfuric acid under solvent-free conditions #
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2 4-dihydroxy benzoic acids #
Spectroscopic quantum chemical DFT/HF study and synthesis of 2.2.1 hept-2-en-2-amino-N-azatricyclo 3.2.1.02 4 octane #
DFT Ab initio and FT-IR studies of the structure of sulfonamide Triazenes #
theoretical studies on tautomerism of dihydropyrimidine tasutomers #
Vibrational spectra and assignments using ab initio and density functional theory analysis on the structure of biotin #
Density functional theory study of intermolecular interactions of cyclic tetrazole dimers #
Synthesis characterization and DFT studies of a novel azo dye derived from racemic or optically active binaphthol #
Synthesis spectroscopic characterization and DFT calculations on 4-(sulfonylazide)phenyl -1-azide #
Asymmetric Syntheses with BINOL-Based Imidoyl Azide #
Theoretical studies on tautomerism of tetrazole derivatives by polarisable continuum method (PCM) #
type: Conference
Title Date
DFT and ab initio calculations of bis pyrrolidiniummethyl urea as corrosion inhibitor
Density functional theory and ab initio Hartree Fock calculations the structure of methyl salicylate
C C coupling of 4-methylpyridine over sulfated-zirconia
Density functional theory and ab initio hartree-fock calculations of the structure of phenyl salicylate
Semiempirical study of the aromaticity and electronic properties of aryloxy tetrazoles
Theoretical studies of the azido-tetrazole isomerization of tetrazole derivatives in the gas phase and solution
Heat of formation of Aryloxy tetrazoles. A semi Empirical study