An experimental NEXAFS and computational TDDFT and ΔDFT study of the gas-phase core excitation spectra of nitroxide free radical TEMPO and its analogues

2016 ◽  
Vol 18 (15) ◽  
pp. 10207-10217 ◽  
Author(s):  
Ivan Ljubić ◽  
Antti Kivimäki ◽  
Marcello Coreno

Core excitation (NEXAFS) C 1s, N 1s, and O 1s gas-phase spectra of stable nitroxide free radical TEMPO and two of its amide-substituted analogues are assigned from the onset of the absorptions to the vicinity of the core-ionization thresholds using the theoretical TDDFT and ΔDFT methods.

1971 ◽  
Vol 36 (1) ◽  
pp. 209-211 ◽  
Author(s):  
John F. W. Keana ◽  
Robert J. Dinerstein ◽  
Friedhelm Baitis

2007 ◽  
Vol 126 (13) ◽  
pp. 134308 ◽  
Author(s):  
G. Fronzoni ◽  
R. De Francesco ◽  
M. Stener ◽  
P. Decleva

1982 ◽  
Vol 60 (12) ◽  
pp. 1448-1451 ◽  
Author(s):  
László Lex ◽  
Kálmán Hideg ◽  
H. Olga Hankovszky

Three methods are described for preparation of a new stable nitroxide free radical amino acid, 2-amino-3-(1-oxyl-2,2,5,5-tetramethyl-3-pyrrolin-3-yl) propionic acid and its derivates. This amino acid may be used as a paramagnetic amino acid synthon in studies of peptides.


1987 ◽  
Vol 246 (3) ◽  
pp. 725-729 ◽  
Author(s):  
M J Davies ◽  
R Donkor ◽  
C A Dunster ◽  
C A Gee ◽  
S Jonas ◽  
...  

In neutral solutions, desferrioxamine (Desferal) can react with the superoxide free radical, O2.- (possibly through its protonated form HO2.), to form a relatively stable nitroxide free radical, which can have a half-life of approx. 10 min at room temperature. The formation of the radical can be largely prevented by the presence of superoxide dismutase. The radical reacts rapidly with cysteine, methionine, glutathione, vitamin C and a water-soluble derivative of vitamin E. It also reacts rapidly with alcohol dehydrogenase, causing a loss of enzyme activity. The implications of these findings for mechanistic free-radical biochemistry and iron-chelation therapy could be considerable.


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