Abstract
In order to explain the differences of acido-basic reactivity of acridine and thionine in their first singlet and triplet excited states, new static indices defined from the bielectronic density matrix are used.
Similar content being viewed by others
References
Weller, A.: Z. Electrochem.61, 956 (1957)
Jackson, G., Porter, G.: Proc. Roy. Soc. A260, 13 (1961)
Becker, R.S.: Theory and interpretation of fluorescence and phosphorescence, p. 240. New York: Wiley 1969
Hatchard, C., Parker, C.A.: Trans. Faraday Soc.57, 1093 (1961)
Fisher, H.: Thesis, University of Stuttgart (1963)
Kato, S., Morita, M., Koizumi, M.: Bull. Chem. Soc. Japan37, 117 (1964)
Joussot-Dubien, J., Favre, J.: J. Chim. Phys.63, 621 (1966)
Favre, J., Bonneau, R., Joussot-Dubien, J.: Photochem. Photobiol.6, 331 (1967)
Grabowska, A., Pakula, B.: Photochem. Photobiol.9, 339 (1969)
Cetina, R., Jain, D.V.S., Peradejordi, F., Chalvet, O., Daudel, R.: C.R. Acad. Sc. Paris264 C, 874 (1967)
Forster, T.: Naturwiss.36, 186 (1949)
Forster, T.: Z. Elektrochem.54, 42 (1950);54, 53 (1950)
Pariser, R., Parr, R.G.: J. Chem. Phys.21, 466 (1953)
Pople, J.A.: Trans. Faraday Soc.49, 1375 (1953)
Chalvet, O., Hoarau, J., Joussot-Dubien, J., Rayez, J.C.: J. Chim. Phys.69, 630 (1972)
Rayez, J.C., Chalvet, O.: J. Chim. Phys.69, 1545 (1972)
Del Bene, J., Jaffe, H.H.: J. Chem. Phys.48, 1807 (1967)
Del Bene, J., Jaffe, H.H.: J. Chem. Phys.48, 4050 (1968)
Del Bene, J., Jaffe, H.H.: J. Chem. Phys.49, 1221 (1968)
Del Bene, J., Jaffe, H.H.: J. Chem. Phys.50, 1126 (1969)
Peradejordi, F.: Cahiers Phys.17, 393 (1963)
Bertran, J., Chalvet, O., Daudel, R.: Theoret. Chim. Acta (Berl.)14, 1 (1969)
Crempien-Laborie,F.: Thèse 3ème Cycle, Paris 1972
de la Serna,E.: D.E.S. Paris 1972
Chalvet,O., Jaffe,H.H., delaSerna,E.: To be published
Chalvet, O., Constanciel, R., Rayez, J.C.: Jerusalem Symposia on Quant. Chem. and Biochem, VI, Jerusalem 1974
Becker, R.S.: See[1]
Rayez,J.C: Thèse 3ème Cycle, Bordeaux, 1969
Coulson, C.A., Longuet-Higgins, H.C.: Proc. Roy. Soc. A191, 39 (1947)
Löwdin, P.O.: Phys. Rev.97, 1474 (1965)
Coleman, A.J.: Rev. Mod. Phys.25, 668 (1963)
Daudel, R., Lefèbvre, R., Moser, C.: Quantum chemistry. New York: Interscience 1959
McWeeny, R.: Phys. Rev.126, 1028 (1962)
McWeeny, R., Diercksen, G.: J. Chem. Phys.49, 4852 (1968)
Constanciel, R.: Theoret. Chim. Acta (Berl.)26, 249 (1972)
Mestetchkin, M.M.: Teor. Eksperim. Kimia4, 154 (1968)
Chalvet, O., Bessis, G., Polydoropoulos, C.: C.R. Acad. Sc. Paris264 C, 1368 (1967)
Constanciel, R.: C.R. Acad. Sc. Paris270 C, 1227 (1970)
Daudel, R.: Théorie quantique de la liaison chimique P.U.F. 1971
McGlynn, S.P., Azumi, T., Kinoshita, M.: Molecular spectroscopy of the triplet state. New York: Prentice Hall 1969
Author information
Authors and Affiliations
Rights and permissions
About this article
Cite this article
Constanciel, R., Chalvet, O. & Rayez, J.C. Comparative study of the pK of acridine, thionine and phenazine molecules in their first excited singlet and triplet states. Theoret. Chim. Acta 37, 305–318 (1975). https://doi.org/10.1007/BF01028399
Received:
Issue Date:
DOI: https://doi.org/10.1007/BF01028399