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Radical pairs and trapped electrons in single crystals of pentaerythritol: an electron spin resonance and pulse radiolysis kinetic study

Journal Article · · J. Phys. Chem.; (United States)
DOI:https://doi.org/10.1021/j150659a030· OSTI ID:5984642
The rate of transformation of radical pairs to monoradicals in ..gamma..-irradiated single crystals of pentaerythritol C(CH/sub 2/OH)/sub 4/, protonated or deuterated in the hydroxyl groups, was obtained by measuring the decay rate of the ESR signal of the radical pairs from 106 to 129 K. An isotope effect in the transformation rate was found and hydrogen atom tunneling seems to be involved. A mechanism is proposed. Pulse radiolysis data have shown that there is an isotope effect also in the decay rate of the optical absorption of electrons trapped in the crystal. The activation energies are 6.7 and 9.0 kcal/mol and the absorption maxima are at 430 and 510 nm for C(CH/sub 2/OH)/sub 4/ and C(CH/sub 2/OD)/sub 4/, respectively. A second moment analysis of the ESR line of the electrons shows that they are most likely trapped in interstitial positions. 20 references, 8 figures, 1 table.
Research Organization:
Studsvik Science Research Lab., Nykoeping, Sweden
OSTI ID:
5984642
Journal Information:
J. Phys. Chem.; (United States), Journal Name: J. Phys. Chem.; (United States) Vol. 88:15; ISSN JPCHA
Country of Publication:
United States
Language:
English

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