Open-shell fullerene C74: phenalenyl-radical substructures
Publication type: Journal Article
Publication date: 2003-08-01
scimago Q2
wos Q2
SJR: 0.546
CiteScore: 5.9
Impact factor: 3.1
ISSN: 00092614, 18734448
Physical and Theoretical Chemistry
General Physics and Astronomy
Abstract
The π-bond distribution and biradical structure of empty fullerene C74 molecule was shown for the first time by the local symmetry analysis followed by DFT calculation. There are two phenalenyl-radical substructures, which are symmetrically disposed on molecular C3 axis of symmetry. An open-shell electronic structure of fullerene C74 is the main reason of its instability as empty species. A pair of added electrons stabilizes C74 as, for example, in its endohedral metallofullerenes. The probable sites of metal atom(s) inside fullerene C74 are discussed. Possible ways of C74 stabilization are outlined.
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Total citations:
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GOST
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Kovalenko V., Khamatgalimov A. Open-shell fullerene C74: phenalenyl-radical substructures // Chemical Physics Letters. 2003. Vol. 377. No. 3-4. pp. 263-268.
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Kovalenko V., Khamatgalimov A. Open-shell fullerene C74: phenalenyl-radical substructures // Chemical Physics Letters. 2003. Vol. 377. No. 3-4. pp. 263-268.
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TY - JOUR
DO - 10.1016/S0009-2614(03)01055-8
UR - https://doi.org/10.1016/S0009-2614(03)01055-8
TI - Open-shell fullerene C74: phenalenyl-radical substructures
T2 - Chemical Physics Letters
AU - Kovalenko, V.I.
AU - Khamatgalimov, A.R
PY - 2003
DA - 2003/08/01
PB - Elsevier
SP - 263-268
IS - 3-4
VL - 377
SN - 0009-2614
SN - 1873-4448
ER -
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BibTex (up to 50 authors)
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@article{2003_Kovalenko,
author = {V.I. Kovalenko and A.R Khamatgalimov},
title = {Open-shell fullerene C74: phenalenyl-radical substructures},
journal = {Chemical Physics Letters},
year = {2003},
volume = {377},
publisher = {Elsevier},
month = {aug},
url = {https://doi.org/10.1016/S0009-2614(03)01055-8},
number = {3-4},
pages = {263--268},
doi = {10.1016/S0009-2614(03)01055-8}
}
Cite this
MLA
Copy
Kovalenko, V.I., and A.R Khamatgalimov. “Open-shell fullerene C74: phenalenyl-radical substructures.” Chemical Physics Letters, vol. 377, no. 3-4, Aug. 2003, pp. 263-268. https://doi.org/10.1016/S0009-2614(03)01055-8.
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