مرور Volume 4, Issue 1, pp. 1-132, Serial No. 10 بر اساس عنوان
در حال نمایش موارد 1 - 8 از 8
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Adsorption and Neutralization Chemistry of Dimethyl Methyl Phosphonate (DMMP) as an Organo-Phosphorous Pollutant (OPP) on the Surface of Nano-Structured Co3O4 and MnCo2O4 Catalysts
(Ilam, Payame Noor University, 2016-01-01)In this work, the practicality of catalytic surfaces of nano-structured Co3O4 and MnCo2O4 for the adsorption and neutralization reactions of dimethyl methyl phosphonate (DMMP) as an toxic agricultural organo-phosphorous ...
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Computational determination of character table and symmetry of fullerenes cage as C24 and C28
(Ilam, Payame Noor University, 2016-01-01)Fullerene chemistry is nowadays a well-established field of both theoretical and experimental investigations. This study considers the symmetry of small fullerenes cage C24 and C28. Using PM3 program for C24 and C28 ...
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DFT calculations on quetiapine hemifumarate as a pharmaceutical compound for the treatment of schizophrenia
(Ilam, Payame Noor University, 2016-01-01)In this work, the optimization calculations were carried out on quetiapine hemifumarat, 4, and its analogues, 1-5. These calculations were carried out using the B3LYP/6-31G(d) level of theory. The DFT calculations clarified ...
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An efficient one-Pot green synthesis of 4H-Benzo[b]pyrans using guanidinium chloride as polyfunctional organocatalyst
(Ilam, Payame Noor University, 2016-01-01)A simple, efficient, and high yielding one-pot protocol has been developed for the synthesis of 4H-benzo[b]pyrans scaffolds installing a three-component tandem Knoevenagel-cyclocondensation reaction of an aldehyde, ...
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Performance of polyaniline/manganese oxide-MWCNT Nanocomposites as Supercapacitors
(Ilam, Payame Noor University, 2016-01-01)Composite electrodes of polyaniline/MnO2-Multi walled carbon nanotube (PANI/MnO2-MWCNT), MnO2-MWCNT nanocomposites and MWCNT was produced by the in situ direct coating approach. The supercapacitor performance of the ...
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Solvent-free and one-pot Biginelli synthesis of 3,4-dihydropyrimidin-2(1H)-ones and 3,4-dihydropyrimidin-2(1H)-thiones using ionic liquid N,N-diethyl-N-sulfoethanammonium chloride {[Et3N–SO3H]Cl} as a green catalyst
(Ilam, Payame Noor University, 2016-01-01)In this work, the ionic liquid triethylamine-bonded sulfonic acid {[Et3N–SO3H]Cl}, N,N-diethyl-N-sulfoethanammonium chloride was used as a green acidic homogeneous catalyst to synthesis of 3,4-dihydropyrimidin-2(1H)-ones ...
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A study on the comparison between thermodynamics and kinetics of reaction of the ozone and mercury, silver and gold
(Ilam, Payame Noor University, 2016-01-01)In this work, we report results of calculations based on the density functional theory of different species metal-ozone, containing mercury, silver and gold. The chosen species range from small molecules and large ...
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The three-component reaction of 2-(2-oxopropyl)isoindoline-1,3-dione with alkyl isocyanides and aromatic carboxylic acids under catalyst-free conditions in water
(Ilam, Payame Noor University, 2016-01-01)A green and convenient protocol is described for the preparation of 1-(alkylamino)-3-(1,3-dioxoisoindolin-2-yl)-2-methyl-1-oxopropan-2-yl benzoates via one-pot three-component reaction between 2-(2-oxopropyl)isoindoline-1,3-dione, ...
