TY - JOUR
T1 - Isotropic hyperfine splitting in the nitroxide radicals 4-amino-2,2,5,5-tetramethyl-3-imidazoline-N-oxyl and 4-amino-2,2,6,6- tetramethylpiperidine-N-oxyl
AU - Ikryannikova, Larissa N.
AU - Ustynyuk, Leila Yu
AU - Trubitsin, Boris V.
AU - Koksharov, Yurii A.
AU - Tikhonov, Alexander N.
N1 - Funding Information:
study was supported by INTAS (grant nos. 99-1086, 01-483 and 03-55-1436), the Russian Foundation for Basic Research (grant no. 03-04-48981) and the ‘Russian Universities’ Foundation (grant no. 01.03.081).
PY - 2004
Y1 - 2004
N2 - Experimentally measured and DFT calculated isotropic hyperfine splitting constants for the nitroxide radicals 4-amino-2,2,5,5-tetramethyl-3-imidazoline- N-oxyl and 4-amino-2,2,6,6-tetramethylpiperidine-N-oxyl were compared to provide the basis for a choice of an appropriate level of low-cost DFT computations of electronic characteristics of nitroxide radicals.
AB - Experimentally measured and DFT calculated isotropic hyperfine splitting constants for the nitroxide radicals 4-amino-2,2,5,5-tetramethyl-3-imidazoline- N-oxyl and 4-amino-2,2,6,6-tetramethylpiperidine-N-oxyl were compared to provide the basis for a choice of an appropriate level of low-cost DFT computations of electronic characteristics of nitroxide radicals.
UR - http://www.scopus.com/inward/record.url?scp=27844597825&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=27844597825&partnerID=8YFLogxK
U2 - 10.1070/MC2004v014n05ABEH001910
DO - 10.1070/MC2004v014n05ABEH001910
M3 - Article
AN - SCOPUS:27844597825
VL - 14
SP - 195
EP - 197
JO - Mendeleev Communications
JF - Mendeleev Communications
SN - 0959-9436
IS - 5
ER -