Collect. Czech. Chem. Commun. 1992, 57, 2494-2500
https://doi.org/10.1135/cccc19922494

Application of Quantum Chemical Calculations to the Identification of Positional Isomers of Polysubstituted Alkylbenzenes

Vladimír Jakuša, Eva Matisováb and Stanislav Miertušb

a Department of Organic Technology, Slovak Technical University, Detached Laboratory at the Research Institute for Petrochemistry, 971 04 Prievidza
b Department of Analytical Chemistry, Slovak Technical University, 812 37 Bratislava

Individual author index pages


Other CCCC articles of these authors

  • Vladimír Jakuš*, Uwe Fuhr, Wolfgang Wörner and Norbert Rietbrock
    Erythrocyte Membrane Fluidity in Diabetics: Fluorescence Study
    1999, Vol. 64, Issue 3, pp. 548–552 [Abstract]
  • Vladimír Jakuš
    Artificial Intelligence in Chemistry
    1992, Vol. 57, Issue 12, pp. 2413–2451 [Abstract]
  • Vladimír Jakuš and Eva Bojsová
    New Phosgene-Free Procedure for Preparation of Methyl N-Phenylcarbamate and Dimethyl Diphenylmethane Dicarbamate as Important Precursors for Producing Iso- and Diisocyanates
    1992, Vol. 57, Issue 7, pp. 1505–1515 [Abstract]
  • Vladimír Jakuš
    Theoretical Interpretation of High-Performance Chromatographic Data for a Heterogeneous Series of Compounds
    1992, Vol. 57, Issue 1, pp. 33–45 [Abstract]
  • Vladimír Jakuš
    Evaluation of adsorption and retention models for separation of polychlorinated biphenyls by HPLC on reversed phases
    1991, Vol. 56, Issue 12, pp. 2849–2858 [Abstract]
  • Vladimír Jakuš and Stanislav Miertuš
    Theoretical interpretation of retention data of polychlorinated biphenyls in liquid chromatography
    1991, Vol. 56, Issue 12, pp. 2833–2848 [Abstract]
  • Stanislav Miertuš and Roman Morávek
    Interpretation of partition between phases and chromatographic retention for a series of oxygen compounds
    1990, Vol. 55, Issue 8, pp. 1943–1958 [Abstract]
  • Viktor Vrábel, František Pavelčík, Eleonóra Kellö, Stanislav Miertuš, Václav Konečný and Jan Lokaj
    The crystal and electron structure of O-(2-chloroethyl)-O-isobutyl-O-(2-phenyl-4-methylthio-3-oxo-2H-pyridazine-5-yl) thiophosphate
    1987, Vol. 52, Issue 3, pp. 696–706 [Abstract]
  • Eleonóra Kellö, Viktor Kettman, Stanislav Miertuš, Viktor Vrábel and Václav Konečný
    The crystal and electron structure of 3-benzylbenzothiazolium bromide
    1986, Vol. 51, Issue 9, pp. 1864–1873 [Abstract]
  • Viktor Vrábel, František Pavelčík, Eleonóra Kellö, Stanislav Miertuš, Václav Konečný and Jan Lokaj
    The crystal and electron structure of N-(2,2,2-trichloro-1-morpholino-ethyl) formamide
    1985, Vol. 50, Issue 8, pp. 1619–1628 [Abstract]
  • Stanislav Miertuš and Vladimír Frecer
    Theoretical study of the electron structure and properties of dithiocarbamates and their complexes with transition metals
    1984, Vol. 49, Issue 12, pp. 2744–2750 [Abstract]
  • Stanislav Miertuš and Magdaléna Trebatická
    Semiempirical calculations of alkylation and protonation energies of bases of nucleic acids
    1983, Vol. 48, Issue 12, pp. 3517–3526 [Abstract]
  • Stanislav Miertuš and Josef Bartoš
    Application of solvaton model to quantum-chemical study of influence of solvation on the chemical process NH3 + HF → NH+4 + F-
    1980, Vol. 45, Issue 8, pp. 2308–2314 [Abstract]
  • Stanislav Miertuš and Ondrej Kyseľ
    Association of radical anion with alkali cations. IV. ESR study of the 4-nitrobenzophenone radical anion
    1980, Vol. 45, Issue 2, pp. 369–375 [Abstract]
  • Stanislav Miertuš, Ondrej Kyseľ and Juraj Danciger
    Association of radical anions alkali metal cations. III. Experimental and theoretical study of the associates of nitrobenzene radical anions with Li+, Na+, K+, Cs+ and (n-C4H9)4N+ cations
    1980, Vol. 45, Issue 2, pp. 360–368 [Abstract]
  • Stanislav Miertuš, Ondrej Kyseľ and Pavol Mach
    Association of radical anions with alkali metal cations; II. Quantum-chemical study of the associates of glyoxal, nitrobenzene and fluorenone with lithium
    1980, Vol. 45, Issue 2, pp. 351–359 [Abstract]
  • Stanislav Miertuš, Ondrej Kyseľ and Pavol Mach
    Association of radical anions with alkali metal cations; I. Modified π(PPP-like) method for the investigation of ion pairs
    1980, Vol. 45, Issue 2, pp. 339–350 [Abstract]