Electron spin echo studies of the solvation structure of O/sub 2//sup -/ in methanol and ethanol
Electron spin echo modulation studies of O/sub 2//sup -/ in specifically deuterated methanol and ethanol glasses have been carried out at 4.2/sup 0/K to determine the solvation structure around O/sub 2//sup -/. The results of the analysis indicate that in both the cases each O/sub 2//sup -/ is solvated by four alcohol molecules. In the case of methanol, the solvent molecules have their H-O bonds oriented toward the II* orbitals of O/sub 2//sup -/ to maximize hydrogen-bonding interactions. This is similar to the O/sub 2//sup -/ solvation structure in water. However, in ethanol the H-O bonds are tilted away from the II* orbitals so that partial molecular dipole orientation of ethanol occurs. As the polar solvent molecule becomes bulkier it appears that molecular dipole orientation becoms more important. This tend is compared with results for solvated electrons in the same solvents. 9 figures, 1 table.
- Research Organization:
- Univ. of Houston, TX
- OSTI ID:
- 6537458
- Journal Information:
- J. Phys. Chem.; (United States), Journal Name: J. Phys. Chem.; (United States) Vol. 86:14; ISSN JPCHA
- Country of Publication:
- United States
- Language:
- English
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Related Subjects
400201 -- Chemical & Physicochemical Properties
400301* -- Organic Chemistry-- Chemical & Physicochemical Properties-- (-1987)
ACOUSTIC ESR
ALCOHOLS
ALKALI METAL COMPOUNDS
CHALCOGENIDES
COMPUTERIZED SIMULATION
DATA
DATA PROCESSING
ELECTRON SPIN RESONANCE
ELEMENTS
ETHANOL
EXPERIMENTAL DATA
GLASS
HYDROXY COMPOUNDS
INFORMATION
LOW TEMPERATURE
MAGNETIC RESONANCE
MATRIX ISOLATION
METHANOL
MIXING
MODULATION
NITROGEN
NONMETALS
NUMERICAL DATA
ORGANIC COMPOUNDS
OXIDES
OXYGEN COMPOUNDS
POTASSIUM COMPOUNDS
POTASSIUM OXIDES
PROCESSING
RADICALS
RESONANCE
SIMULATION
SOLVATION
SOLVENT PROPERTIES
STRUCTURAL CHEMICAL ANALYSIS
SUPEROXIDE RADICALS
TEMPERATURE DEPENDENCE
TIME DEPENDENCE
ULTRALOW TEMPERATURE