The nitrogen and β-hydrogen hyperfine splitting constants (hfsc) for phenyl, 4-nitrophenyl, 4-pyridyl, benzoyl, and trichloromethyl spin adducts of α-phenyl tert-butyl nitrone (PBN) as well as for the tert-butoxyl adduct of 5,5-dimethylpyrroline-N-oxide (DMPO) have been obtained as a function of solvent (30 solvents). A useful linear relationship between the β-H hfsc and the N-hfsc of each aminoxyl is found except for the benzoyl adduct of PBN. Some speculations regarding the structural significance of these correlations is presented.
A computer program written in BASIC is presented for the simulation of isotropic esr spectra using a microprocessor. Since BASIC is the most common microprocessor language, this program can easily be adapted to most microprocessors. Through the use of more efficient methods the capabilities of much larger FORTRAN programs, run on mainframe computers, are retained in the more restricted environment of the microprocessor. As a result, most spin trapping results can be dealt with easily. A number of sample simulations illustrate the program's features. On présente un programme pour ordinateur écrit dans le langage BASIC pour la simulation des spectres de rpe isotropes à l'aide d'un micropresseur. Puisque le langage BASIC est le plus courant des langages des microprocesseurs, on peut facilement adapter ce programme à la plupart des microprocesseurs. En faisant appel à des méthodes plus efficaces, on a retenu, dans l'environnement plus restreint du microprocesseur, les possibilités qu'offrent les programmes FORTRAN plus étendus utilisés de concert avec des ordinateurs centraux. Par conséquent, la plupart des expériences de captage de spin peuvent être traités facilement. Un certain nombre de simulations d'échantillons illustre les caractéristiques du programme.[Traduit par le journal]
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