Molecular Complexes of p-Chloranil with Aniline, Phenol and their Derivatives

Author:

Pryalkin Boris S.1,Bodagova Yulia S.1

Affiliation:

1. National Research Tomsk State University

Abstract

Classification of simple supramolecular structures (for example molecular complexes), which has been introduced and described by Mulliken [1], is based on types of molecular orbitals of the components. In the paper [2], disadvantages of such classification are shown, which motivate us to return to the re-examination properties of molecular complexes. By this reason, there is a need to research the molecular complexes of one electron acceptor with a wide range of electron donor molecules. This paper have continued work (Part I [3]) on the chloranil complexes by studying the spectral properties complexes of N- and O-unsubstituting anilines and phenols. The present work aimed at analyzing linear relation the energies of charge-transfer bands of molecular complexes are related to ionization potentials of the donor components. All complexes conform to linear relations like involving both adiabatic and vertical ionization potentials of donor components. Mulliken [1] has been proposed to apply the vertical ionization potentials of donor components only. The development of photoelectron spectroscopy has led to the measurement of adiabatic and vertical ionization energies for thousands of molecules, which allow theirs to the present analysis of spectral properties molecular complexes.

Publisher

Trans Tech Publications, Ltd.

Subject

Mechanical Engineering,Mechanics of Materials,General Materials Science

Reference20 articles.

1. R.S. Mulliken, and W.B. Person, Molecular Complexes, New York: Wiley, (1969).

2. B.S. Pryalkin, Molecular Complexes of 1, 3, 5-Trinitrobenzene with Naphthalene and Its Derivatives, Russ, J. Gen. Chem., 79 (2009) 2359-2366.

3. B.S. Pryalkin, Molecular Complexes of Quinones: I. π–π Complexes of p-Chloranil with Benzene and Its Derivatives, Russ. J. Gen. Chem., 83 (2013) 303-310.

4. E.N. Guryanova, I.P. Goldshtein, I.P. Romm, The Donor–Acceptor Bond Moscow, Chemistry (Moskva, Khimiya - in Russian), (1973).

5. V.I. Vovna, Electronic Structure of Organic Compounds according to the Data of Photoelectron Spectroscopy Moscow: Science (Moskva: Nauka - in Russian), (1991).

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