Articles

type: Journal
Title DOI Date
Catalytic conversion of alcohols over alumina zirconia mixed oxides Reactivity and selectivity # 1390 - 04
Linear free energy relationship for the anomeric effect MP2 DFT and ab initio study of 2-substituted-1 4-dioxanes # 1390 - 02
Formation of gama-alumina nanorods in presence of alanine # 1389 - 11
Conformational analysis and intramolecular/intermolecular interactions of N N -dibenzylideneethylenediamine derivatives # 1389 - 08
Effects of vacuum and calcination temperature on the structure texture reactivity and selectivity of alumina Experimental and DFT studies # 1389 - 01
Nanoscale surface study and reactions mechanism of 2-butanol over the gama-alumina (1 0 0) surface and nanochannel A DFT study # 1388 - 10
Influence of B Ga and In impurities in the structure and electronic properties of alumina nanoball # 1388 - 10
Influence of B Ga and In impurities in the structure and electronic properties of alumina nanoball # 1388 - 10
Theoretical studies on tautomerism of triazole derivatives in the gas phase and solution # 1388 - 01
DFT ab initio NMR and NBO analyses of Na-substituted hydrazino acetamides experimental VS theoretical values # 1388 - 01
Dynamic 1H-NMR demonstration of anomeric effect and configurational analysis of N-2-(1 4-dioxane)-N -(p-methylbenzenesulfonyl)-O-(p-methylphenoxy) isourea # 1387 - 12
Experimental and CIS TD-DFT ab initio calculations of visible spectra and the vibrational frequencies of sulfonyl azide-azoic dyes # 1387 - 10
p-Toluenesulfonic acid a useful and selective reagent for the oxidation of benzoins to benziles under solvent-free condition # 1387 - 07
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 # 1387 - 01
DFT and ab initio potential energy scan and hydrogen bond analysis of Na-substituted hydrazino acetamides characterization of the hydrazinoturn hydrogen bonding pattern # 1387 - 01
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2 4-dihydroxy benzoic acids # 1387 - 01
DFT Ab initio and FT-IR studies of the structure of sulfonamide Triazenes # 1386 - 12
theoretical studies on tautomerism of dihydropyrimidine tasutomers # 1386 - 10
Insertion Reaction of Azidosulfonyl Azo Dye with Model Alicyclic and heterocyclic compounds # 1386 - 01
Density functional theory study of intermolecular interactions of cyclic tetrazole dimers # 1386 - 01