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On the spin distribution in the monoprotonated 1,4-Benzosemiquinone radical

1976; Elsevier BV; Volume: 44; Issue: 3 Linguagem: Inglês

10.1016/0009-2614(76)80724-5

1873-4448

Jens Spanget‐Larsen,

Photochemistry and Electron Transfer Studies

An INDO calculation based on a properly optimized geometry and extended to include a large contribution from the solvent is shown to lead to a satisfactory description of the ESR spectrum of the monoprotonated 1,4-benzosemiquinone radical.