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2-Alkylidene-4-oxothiazolidine S-oxides: synthesis and stereochemistry
(Oxford : Pergamon-Elsevier Science Ltd, 2013)
A series of 5-unsubstituted and 5-substituted 2-alkylidene-4-oxothiazolidine-S-oxides were synthesized by the sulfur-oxidation with m-CPBA. The stereochemistry of 5-substituted sulfoxides was determined by means of NMR ...
Unusual mode of reactivity of 2-alkylidene-4-oxothiazolidine S-oxides under the Pummerer reaction conditions
(Oxford : Pergamon-Elsevier Science Ltd, 2013)
The reactivity of 2-alkylidene-4-oxothiazolidine S-oxides under the Pummerer reaction conditions, using Ac2O, TFAA, SOCl2 and SOBr2 as initiators, has been examined. Almost all reactions proceeded with absolute regioselectivity ...
Magnetic Anisotropy of the C-C Single Bond
(Wiley-V C H Verlag Gmbh, Weinheim, 2013)
Anisotropic effects are broadly used in NMR spectroscopy for structure elucidation. With the development of computational methods it has become possible to quantify the effects and obtain further insight into their origin. ...
H-1 NMR Chemical Shifts of Cyclopropane and Cyclobutane: A Theoretical Study
(American Chemical Society (ACS), 2013)
This study was undertaken in order to rationalize the peculiar H-1 NMR chemical shifts of cyclopropane (delta 0.22) and cyclobutane (delta 1.98) which are shifted upfield and downfield with respect to larger cycloalkanes ...
Electrooxidation of p-nitrophenol on organobentonite modified electrodes
(Elsevier, 2013)
A natural bentonite, modified with different quaternary ammonium cations, hexadecyl trimethylammonium, (HDTMA), dodecyl trimethylammonium (DTMA) and tetramethylammonium (TMA), was used as an electrode material in a ...
The choice of the exchange-correlation functional for the determination of the Jahn-Teller parameters by the density functional theory
(Wiley-Blackwell, Hoboken, 2013)
The JahnTeller (JT) parameters for small, aromatic, organic radicals, CnHn (n = 47), bis(cyclopentadienyl)cobalt(II) (cobaltocene), a sodium cluster (Na3), a silver cluster (Ag3), the hexaflurocuprate(II) ion ([CuF6]4), ...
Density functional theory study of the multimode Jahn-Teller problem in the fullerene anion
(Wiley-Blackwell, Hoboken, 2013)
The fullerene anion, C60, within the Ih point group, is a spherical molecule subject to the T circle times h JahnTeller (JT) distortion. The descent in symmetry goes to the three epikernel subgroups, namely D5d, D3d, and ...
Cyanotoxins: Characteristics, production and degradation routes in drinking water treatment with reference to the situation in Serbia
(Oxford : Pergamon-Elsevier Science Ltd, 2013)
Cyanobacteria are members of phytoplankton of the surface freshwaters. The accelerated eutrophication of freshwaters, especially reservoirs for drinking water, by human activity has increased the occurrence and intensity ...
Biochemical and immunological characterization of a recombinantly-produced antifungal cysteine proteinase inhibitor from green kiwifruit (Actinidia deliciosa)
(Oxford : Pergamon-Elsevier Science Ltd, 2013)
Plant proteinase inhibitors are considered important defense molecules against insect and pathogen attack. The cysteine proteinase inhibitor (CPI) from green kiwifruit (Actinidia deliciosa) belongs to the cystatin family ...
General treatment of the multimode Jahn-Teller effect: study of fullerene cations
(Royal Soc Chemistry, Cambridge, 2013)
A general model for the analysis of the Adiabatic Potential Energy Surfaces (APES) of the molecules that are subject to the multimode Jahn-Teller effect is presented. The method utilizes the information obtained by DFT ...