EasySpin forum

% fast-motional cw EPR spectrum simulation of a nitroxide radical %========================================================================== % bestvalues: [-4] clear, clf [exp,spc] = eprload('c:\users\kk\onedrive - uniwersytet Jagielloński\data\arnab280324\AD00216_dimer-ox2-kk4-160K-p2.DTA'); % Bru...

Thx, I will try to simulate my spectrum according your suggestion.
Best,
KK

TEMPO in not fluorinated but it is a ligand however phenyl ligand is fluorinated: [(C6F5)2Zn(TEMPO)2]
As an attachment please find the structure of the compounds (correct ext. CIF, Mercury file).
Best,
KK

Dear Stefan, I use your program EasySpin to simulate the rotational ESR spectra of TEMPO in different environment. The software works pretty well, however lately I got problem with simulation the one spectrum (please see attached file). I believe that in addition to the slow motional spectrum from T...