Abstract
The floating spherical gaussian orbital method is employed for predicting the shape of C2H +7 . The pentavalency of carbon may be explained by the presence of a two-electron three-centre bond in addition to the standard two-electron two-centre bonds in this ion.
Similar content being viewed by others
References
Aquilanti,V., Volpi,G.G.: J. chem. Physics 44, 2307 (1966).
Munson,M.S.B., Field,F.H.: J. Amer. chem. Soc. 87, 3294 (1965).
von Koch,H.: Ark. Fysik 28, 559 (1965).
Futrell,J.H., Abramson, F.P., Bhattacharya,A.K., Tiernan,T.O.: J. chem. Physics 52, 3655 (1970).
Tal'rose,V.L., Lyubimova,A.K.: Dokl. Akad. Nauk. SSSR 86, 909 (1952); Field,F.H., Munson, M.S.B.: J. Amer. chem. Soc. 87, 3289 (1965).
Olah,G.A., Schlosberg,R.H.: J. Amer. chem. Soc. 90, 2726 (1968).
Fink,W.: Thesis, Princeton, N.J. (1966), quoted by Allen,L.C.: Quantum theory of atoms, molecules and the solid state, p. 62, ed. P. O. Löwdin. New York: Academic 1966.
Gole,J.L.: Chem. Physics Letters 3, 577 (1969); 4, 408 (1969).
Yanezawa,T., Naktsuji,H., Kato,H.: J. Amer. chem. Soc. 90, 1239 (1968).
Gamba,A., Moroso,G., Simonetta,M.: Chem. Physics Letters 3, 20 (1969).
Ehrenson,S.: Chem. Physics Letters 3, 585 (1969).
Olah,G.A., Klopman,G., Schlosberg,R.H.: J. Amer. chem. Soc. 91, 3261 (1969).
Van der Lugt, W.Th.A.M., Ros,P.: Chem. Physics Letters 4, 389 (1969).
Dyczmons,V., Staemmler,V., Kutzelnigg,W.: Chem. Physics Letters 5, 361 (1970).
Frost,A.A.: J. chem. Physics 47, 3707 (1967).
Obtained from QCPE, Chemistry Department, Indiana University, Bloomington, Indiana 47401.
Frost,A.A., Rouse,R.A.: J. Amer. chem. Soc. 90, 1965 (1968).
Author information
Authors and Affiliations
Additional information
Aided by a research grant to The Johns Hopkins University from the National Institutes of Health.
The auther is grateful to Professor Robert G. Parr for his kind interest in this work.
Rights and permissions
About this article
Cite this article
Ray, N.K. Theoretical study of the structure of protonated ethane (C2H +7 ). Theoret. Chim. Acta 23, 111–114 (1971). https://doi.org/10.1007/BF00530208
Received:
Issue Date:
DOI: https://doi.org/10.1007/BF00530208