List of works - Sergiy I. Okovytyy

A Counterion-Directed Approach to the Diels-Alder Paradigm: Cascade Synthesis of Tricyclic Fused Cyclopropanes

scientific article published on 07 October 2016

Alkaline hydrolysis of hexahydro-1,3,5-trinitro-1,3,5-triazine: M06-2X investigation.

scientific article published on 22 April 2015

Catalytic enantioselective synthesis of indanes by a cation-directed 5-endo-trig cyclization

scientific article published in February 2014

Comprehensive DFT and MP2 level investigations of reaction of 2,3-dihydro-1,5-benzodiazepine-2-thiones with hydrazine.

scientific article published in October 2009

Comprehensive investigations of kinetics of alkaline hydrolysis of TNT (2,4,6-trinitrotoluene), DNT (2,4-dinitrotoluene), and DNAN (2,4-dinitroanisole).

scientific article published on 15 August 2014

Computational study of the aminolysis of anhydrides: effect of the catalysis to the reaction of succinic anhydride with methylamine in gas phase and nonpolar solution.

scientific article published on 21 May 2008

DFT M06-2X investigation of alkaline hydrolysis of nitroaromatic compounds.

scientific article published on 17 April 2012

Erratum: Catalytic enantioselective synthesis of indanes by a cation-directed 5-endo-trig cyclization

scientific article published on 01 April 2015

Erratum: Corrigendum: Catalytic enantioselective synthesis of indanes by a cation-directed 5-endo-trig cyclization

scientific article published on 01 March 2016

Ethanolysis of N-substituted norbornane epoxyimides: discovery of diverse pathways depending on substituent's character.

scientific article published on 9 March 2010

Hydrazinolysis of 3-R-[1,2,4]triazino[2,3-c]quinazolin-2-ones. Synthetic and theoretical aspects

scientific article published on 26 February 2014

In Silico Alkaline Hydrolysis of Octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine: Density Functional Theory Investigation.

scientific article published on 15 August 2016

In silico kinetics of alkaline hydrolysis of 1,3,5-trinitro-1,3,5-triazinane (RDX): M06-2X investigation.

scientific article published on 12 January 2017

Origin of Substituent Effect on Tautomeric Behavior of 1,2,4-Triazole Derivatives: Combined Spectroscopic and Theoretical Study.

scientific article published on 15 December 2016

Prediction of CL-20 chemical degradation pathways, theoretical and experimental evidence for dependence on competing modes of reaction.

scientific article published in October 2005

QSPR modeling of optical rotation of amino acids using specific quantum chemical descriptors

scientific article published on 17 February 2018

Role of Singlet Oxygen in the Degradation of Selected Insensitive Munitions Compounds: A Comprehensive, Quantum Chemical Investigation

scientific article published on 23 August 2019

The mechanism of unimolecular decomposition of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane. A computational DFT study.

scientific article published in March 2005

The performance of the new 6-31G(##) basis set: molecular structures and vibrational frequencies of transition metal carbonyls

scientific article published in March 2007

List of works by Sergiy I. Okovytyy