Role of the charge-transfer state in the electronic absorption of protonated hydrocarbon molecules
The vibrationally resolved electronic spectra of isolated protonated polycyclic aromatic hydrocarbons (PAHs)-naphthalene, anthracene, and tetracene-have been recorded via neutral photofragment spectroscopy. The S 1←S0 transitions are all in the visible region and do not show a monotonic red shift as...
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American Chemical Society
2010
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| Acceso en línea: | Registro en Scopus DOI Handle Registro en la Biblioteca Digital |
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| LEADER | 08033caa a22011657a 4500 | ||
|---|---|---|---|
| 001 | PAPER-7387 | ||
| 003 | AR-BaUEN | ||
| 005 | 20230518203707.0 | ||
| 008 | 190411s2010 xx ||||fo|||| 00| 0 eng|d | ||
| 024 | 7 | |2 scopus |a 2-s2.0-78650095285 | |
| 024 | 7 | |2 cas |a anthracene, 120-12-7; naphthalene, 91-20-3 | |
| 040 | |a Scopus |b spa |c AR-BaUEN |d AR-BaUEN | ||
| 030 | |a JACSA | ||
| 100 | 1 | |a Alata, I. | |
| 245 | 1 | 0 | |a Role of the charge-transfer state in the electronic absorption of protonated hydrocarbon molecules |
| 260 | |b American Chemical Society |c 2010 | ||
| 270 | 1 | 0 | |m Jouvet, C.; Centre Laser de l'Université Paris Sud (LUMAT FR 2764), Bât. 106, Université Paris-Sud 11, 91405 Orsay Cedex, France; email: christophe.jouvet@u-psud.fr |
| 506 | |2 openaire |e Política editorial | ||
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| 520 | 3 | |a The vibrationally resolved electronic spectra of isolated protonated polycyclic aromatic hydrocarbons (PAHs)-naphthalene, anthracene, and tetracene-have been recorded via neutral photofragment spectroscopy. The S 1←S0 transitions are all in the visible region and do not show a monotonic red shift as a function of the molecular size, as observed for the neutral analogues. Comparison with ab initio calculations indicates that this behavior is due to the nature of the excited state, which has a pronounced charge-transfer character for protonated linear PAHs with an even number of aromatic rings. © 2010 American Chemical Society. |l eng | |
| 593 | |a Centre Laser de l'Université Paris Sud (LUMAT FR 2764), Bât. 106, Université Paris-Sud 11, 91405 Orsay Cedex, France | ||
| 593 | |a Atomic Energy Commission of Syria, P.O. Box 6091, Damascus, Syrian Arab Republic | ||
| 593 | |a Institut des Sciences Moléculaires d'Orsay, Bât. 210, Université Paris-Sud 11, 91405 Orsay Cedex, France | ||
| 593 | |a INQUIMAE-FCEN, UBA, Ciudad Universitaria, 3er piso, Pab. II, 1428 Buenos Aires, Argentina | ||
| 690 | 1 | 0 | |a CALCULATIONS |
| 690 | 1 | 0 | |a CHARGE TRANSFER |
| 690 | 1 | 0 | |a EXCITED STATES |
| 690 | 1 | 0 | |a HYDROCARBONS |
| 690 | 1 | 0 | |a MOLECULES |
| 690 | 1 | 0 | |a NAPHTHALENE |
| 690 | 1 | 0 | |a PROTONATION |
| 690 | 1 | 0 | |a AB INITIO CALCULATIONS |
| 690 | 1 | 0 | |a CHARGE TRANSFER STATE |
| 690 | 1 | 0 | |a ELECTRONIC ABSORPTION |
| 690 | 1 | 0 | |a ELECTRONIC SPECTRUM |
| 690 | 1 | 0 | |a HYDROCARBON MOLECULES |
| 690 | 1 | 0 | |a PHOTOFRAGMENTS |
| 690 | 1 | 0 | |a POLYCYCLIC AROMATIC HYDROCARBONS (PAHS) |
| 690 | 1 | 0 | |a VIBRATIONALLY RESOLVED |
| 690 | 1 | 0 | |a POLYCYCLIC AROMATIC HYDROCARBONS |
| 690 | 1 | 0 | |a ANTHRACENE |
| 690 | 1 | 0 | |a NAPHTHACENE |
| 690 | 1 | 0 | |a NAPHTHALENE |
| 690 | 1 | 0 | |a POLYCYCLIC AROMATIC HYDROCARBON |
| 690 | 1 | 0 | |a UNCLASSIFIED DRUG |
| 690 | 1 | 0 | |a AB INITIO CALCULATION |
| 690 | 1 | 0 | |a ABSORPTION SPECTROSCOPY |
| 690 | 1 | 0 | |a ANALYTIC METHOD |
| 690 | 1 | 0 | |a ARTICLE |
| 690 | 1 | 0 | |a INTERMETHOD COMPARISON |
| 690 | 1 | 0 | |a MOLECULAR SIZE |
| 690 | 1 | 0 | |a MOLECULE |
| 690 | 1 | 0 | |a NEUTRAL PHOTOFRAGMENT SPECTROSCOPY |
| 690 | 1 | 0 | |a PROTON TRANSPORT |
| 690 | 1 | 0 | |a VIBRATION |
| 690 | 1 | 0 | |a VIBRATIONAL ANALYSIS |
| 700 | 1 | |a Dedonder, C. | |
| 700 | 1 | |a Broquier, M. | |
| 700 | 1 | |a Marceca, E. | |
| 700 | 1 | |a Jouvet, C. | |
| 773 | 0 | |d American Chemical Society, 2010 |g v. 132 |h pp. 17483-17489 |k n. 49 |p J. Am. Chem. Soc. |x 00027863 |w (AR-BaUEN)CENRE-19 |t Journal of the American Chemical Society | |
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| 856 | 4 | 0 | |u https://doi.org/10.1021/ja106424f |y DOI |
| 856 | 4 | 0 | |u https://hdl.handle.net/20.500.12110/paper_00027863_v132_n49_p17483_Alata |y Handle |
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