ESR Studies and the Electronic Structure of Vanadyl Ion Complexes

作者: Daniel Kivelson , Sai‐Kwing Lee

DOI: 10.1063/1.1726180

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摘要: The ESR spectra of vanadyl acetylacetonate and tetraphenylporphyrin have been studied in various liquid solvents frozen glasses. analyzed the components g tensor vanadium hyperfine interaction tensors determined, for porphyrin nitrogen extrahyperfine has obtained. unpaired electron is b2g* orbital. splitting very isotropic which indicates that orbital localized on complex ``in‐plane π bonding'' slight. An explanation origin this discussed terms configuration interaction. analysis also, Fermi contact depends upon a number excited configurations varies from to with change solvent. g‐tensor suggests...

参考文章(25)
Erwin Bareiss, D. R. Hartree, The calculation of atomic structures ,(1957)
Ellery W. Stone, August H. Maki, ESR Study of Polyazine Anions The Journal of Chemical Physics. ,vol. 39, pp. 1635- 1642 ,(1963) , 10.1063/1.1734505
A. Carrington, J. dos Santos-Veiga, Electron spin resonance spectra of nitrogen heterocyclic radical ions Molecular Physics. ,vol. 5, pp. 21- 29 ,(1962) , 10.1080/00268976200100031
H. C. Longuet‐Higgins, C. W. Rector, J. R. Platt, Molecular Orbital Calculations on Porphine and Tetrahydroporphine The Journal of Chemical Physics. ,vol. 18, pp. 1174- 1181 ,(1950) , 10.1063/1.1747907
E. M. Roberts, W. S. Koski, W. S. Caughey, Electron Spin Resonance of Some Vanadyl Porphyrins The Journal of Chemical Physics. ,vol. 34, pp. 591- 593 ,(1961) , 10.1063/1.1700990
A. H. Maki, B. R. McGarvey, Electron Spin Resonance in Transition Metal Chelates. I. Copper (II) Bis-Acetylacetonate Journal of Chemical Physics. ,vol. 29, pp. 31- 34 ,(1958) , 10.1063/1.1744456
S. I. Weissman, Isotropic Hyperfine Interactions in Aromatic Free Radicals The Journal of Chemical Physics. ,vol. 25, pp. 890- 891 ,(1956) , 10.1063/1.1743137
Robert Neiman, Daniel Kivelson, ESR Line Shapes in Glasses of Copper Complexes Journal of Chemical Physics. ,vol. 35, pp. 156- 161 ,(1961) , 10.1063/1.1731881
Daniel Kivelson, Robert Neiman, ESR Studies on the Bonding in Copper Complexes Journal of Chemical Physics. ,vol. 35, pp. 149- 155 ,(1961) , 10.1063/1.1731880
H. R. Gersmann, J. D. Swalen, Electron Paramagnetic Resonance Spectra of Copper Complexes The Journal of Chemical Physics. ,vol. 36, pp. 3221- 3233 ,(1962) , 10.1063/1.1732450