Crossref Cited-by Linking logo

Collect. Czech. Chem. Commun. 1980, 45, 1646-1654

Perturbation theory of substituent effect. Quantum chemical estimation of the Hammet ρ constants

Robert Ponec

Institute of Chemical Process Fundamentals, Czechoslovak Academy of Sciences, 165 02 Prague 6-Suchdol

Crossref Cited-by Linking

  • AMAT LLUÍS, CARBÓ-DORCA RAMON, COOPER DAVID L., ALLAN NEIL L., PONEC ROBERT: Structure—property relationships and momentum space quantities: Hammett σ—constants. Molecular Physics 2003, 101, 3159. <>
  • Gineityte V.: Block diagonalization problem for a Fockian matrix of molecule and its solution by means of noncommutative Rayleigh-Schr�dinger perturbation theory. Int. J. Quant. Chem. 1998, 68, 119. <<119::AID-QUA4>3.0.CO;2-Y>
  • Gineityte V.: Additive components of heteroatom influence in substituted alkanes. Polarization and depolarization of bonds. Journal of Molecular Structure: THEOCHEM 1998, 434, 43. <>
  • Gineityte V.: Interpretation of the inductive effect of heteroatoms in substituted alkanes on the basis of both the one-electron density matrix and localized molecular orbitals. Journal of Molecular Structure: THEOCHEM 1996, 364, 85. <>
  • Vysotskii Yu. B.: Quantum chemical study of the substituent effect on pKa of molecules with conjugated bonds using the PPP method. Theor Exp Chem 1988, 24, 12. <>