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1,3,5-C6H3F3+


Vibrational and/or electronic energy levels

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Marilyn E. Jacox

State:   B


 Energy 
 (cm-1
 Med.   Transition   «lambda»min 
 (nm) 
 «lambda»max 
 (nm) 
 References

To = 21867.479 gas B-X 425 571 Allan and Maier, 1975
Miller and Bondybey, 1978
Cossart-Magos, Cossart, et al., 1979
Bondybey, Sears, et al., 1980
Tuckett, 1981
Klapstein, Leutwyler, et al., 1984
Tsuchiya, Fujii, et al., 1989
Yu, Foster, et al., 1990
To = 21776 Ne B-X 364 460 Bondybey, Miller, et al., 1979


Vib. 
sym. 
 No.   Approximate 
 type of mode 
 cm-1   Med.   Method   References

a1' 3 995 gas EM LF Cossart-Magos, Cossart, et al., 1979
Bondybey, Sears, et al., 1980
3 1005 Ne LF Bondybey, Miller, et al., 1979
4 569 gas LF EM Miller and Bondybey, 1978
Cossart-Magos, Cossart, et al., 1979
Bondybey, Sears, et al., 1980
4 571 Ne LF Bondybey, Miller, et al., 1979
e' 9 1499 gas LF Miller and Bondybey, 1978
Bondybey, Sears, et al., 1980
9 1505 Ne LF Bondybey, Miller, et al., 1979
12 954 gas LF Bondybey, Sears, et al., 1980
12 959 Ne LF Bondybey, Miller, et al., 1979
13 489.99 gas LF Miller and Bondybey, 1978
Sears, Miller, et al., 1980
Bondybey, Sears, et al., 1980
Yu, Foster, et al., 1990
13 484 Ne LF Bondybey, Miller, et al., 1979
Bondybey, English, et al., 1983
14 323.81 gas LF Sears, Miller, et al., 1980
Bondybey, Sears, et al., 1980
Yu, Foster, et al., 1990
14 327 Ne LF Bondybey, Miller, et al., 1979
17 198 H gas LF Bondybey, Sears, et al., 1980
17 209 H Ne LF Bondybey, Miller, et al., 1979
e 80 H gas ID Tsuchiya, Fujii, et al., 1989

State:   X


Vib. 
sym. 
 No.   Approximate 
 type of mode 
 cm-1   Med.   Method   References

a1' 1 2911 gas EM Cossart-Magos, Cossart, et al., 1979
2 1465 gas EM Cossart-Magos, Cossart, et al., 1979
3 1039.1 gas EM EF Cossart-Magos, Cossart, et al., 1979
Tuckett, 1981
Klapstein, Leutwyler, et al., 1984
3 1043 Ne LF Bondybey, Miller, et al., 1979
4 592.1 gas EM LF Cossart-Magos, Cossart, et al., 1979
Bondybey, Miller, et al., 1979
4 592.1 gas EF Tuckett, 1981
Klapstein, Leutwyler, et al., 1984
4 596 Ne LF Bondybey, Miller, et al., 1979
e' 9 1665 gas EM Cossart-Magos, Cossart, et al., 1979
9 1664 Ne LF Bondybey, Miller, et al., 1979
10 1533 gas EM Cossart-Magos, Cossart, et al., 1979
12 945 Ne LF Bondybey, Miller, et al., 1979
13 550.0 gas EM LF Cossart-Magos, Cossart, et al., 1979
Bondybey, Miller, et al., 1979
13 550.0 gas EF Tuckett, 1981
Klapstein, Leutwyler, et al., 1984
13 557 Ne LF Bondybey, Miller, et al., 1979
Bondybey, English, et al., 1983
14 334 Ne LF Bondybey, Miller, et al., 1979
Bondybey, English, et al., 1983

Additional references: Jacox, 1994, page 433; Allan, Maier, et al., 1977; Bondybey and Miller, 1979; Cossart-Magos, Cossart, et al., 1979, 2; Dujardin, Leach, et al., 1980; Maier and Thommen, 1981; Bondybey, Vaughn, et al., 1981

Notes

H(1/2)(2nu)
oEnergy separation between the v = 0 levels of the excited and electronic ground states.

References

Go To: Top, Vibrational and/or electronic energy levels, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Allan and Maier, 1975
Allan, M.; Maier, J.P., Emission spectra of the radical cations of hexa-, penta-, tetra-, and tri-fluorobenzenes, Chem. Phys. Lett., 1975, 34, 3, 442, https://doi.org/10.1016/0009-2614(75)85535-7 . [all data]

Miller and Bondybey, 1978
Miller, T.A.; Bondybey, V.E., Laser fluorescence excitation spectra of the 1,3,5-trifluorobenzene radical cation, Chem. Phys. Lett., 1978, 58, 3, 454, https://doi.org/10.1016/0009-2614(78)85074-X . [all data]

Cossart-Magos, Cossart, et al., 1979
Cossart-Magos, C.; Cossart, D.; Leach, S., Emission spectra of seven fluorobenzene cations, Mol. Phys., 1979, 37, 3, 793, https://doi.org/10.1080/00268977900103201 . [all data]

Bondybey, Sears, et al., 1980
Bondybey, V.E.; Sears, T.J.; English, J.H.; Miller, T.A., Low temperature gas phase and matrix studies of the C6H3F3+ and C6H3Cl3+ radical cations, J. Chem. Phys., 1980, 73, 5, 2063, https://doi.org/10.1063/1.440373 . [all data]

Tuckett, 1981
Tuckett, R.P., Fluorescence spectra of fluorobenzene cations excited in a supersonic molecular beam, Chem. Phys., 1981, 58, 2, 151, https://doi.org/10.1016/0301-0104(81)80052-3 . [all data]

Klapstein, Leutwyler, et al., 1984
Klapstein, D.; Leutwyler, S.; Maier, J.P.; Cossart-Magos, C.; Cossart, D.; Leach, S., The, Mol. Phys., 1984, 51, 2, 413, https://doi.org/10.1080/00268978400100281 . [all data]

Tsuchiya, Fujii, et al., 1989
Tsuchiya, Y.; Fujii, M.; Ito, M., Electronic spectra of isolated cations in supersonic jets by mass-selected ion-dip spectroscopy. Cations of benzene, p-difluorobenzene, and 1,3,5-trifluorobenzene, J. Chem. Phys., 1989, 90, 12, 6965, https://doi.org/10.1063/1.456272 . [all data]

Yu, Foster, et al., 1990
Yu, L.; Foster, S.C.; Williamson, J.M.; Miller, T.A., High-resolution electronic spectroscopy of jet-cooled hexafluorobenzene and 1,3,5-trifluorobenzene cations, C6F+6 and C6F3H+3, J. Chem. Phys., 1990, 92, 10, 5794, https://doi.org/10.1063/1.458399 . [all data]

Bondybey, Miller, et al., 1979
Bondybey, V.E.; Miller, T.A.; English, J.H., Laser induced fluorescence spectra of symmetrically substituted trihalobenzene radical cations, J. Chem. Phys., 1979, 71, 3, 1088, https://doi.org/10.1063/1.438474 . [all data]

Sears, Miller, et al., 1980
Sears, T.; Miller, T.A.; Bondybey, V.E., Selectively excited, wavelength resolved emission spectra of gaseous organic ions, J. Chem. Phys., 1980, 72, 12, 6749, https://doi.org/10.1063/1.439164 . [all data]

Bondybey, English, et al., 1983
Bondybey, V.E.; English, J.H.; Miller, T.A., Spectroscopic and dynamical studies of vibrationally unrelaxed fluorescence from halobenzene cations in a neon matrix, J. Phys. Chem., 1983, 87, 8, 1300, https://doi.org/10.1021/j100231a007 . [all data]

Jacox, 1994
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules, American Chemical Society, Washington, DC, 1994, 464. [all data]

Allan, Maier, et al., 1977
Allan, M.; Maier, J.P.; Marthaler, O., Radative relaxation of the B(«pi»-1)EXCITED ELECTRONIC STATES OF THE RADICAL CATIONS OF REXAFLUOROBENZENE, PENTAFLUOROBENZENE, 1,2,3,4-, 1,2,3,5-, 1,2,4,5-TETRAFLUOROBENZENE, 1,3,5-, 1,2,4-TRIFLUOROBENZENE AND 1,3-DIFLUOROBENZENE, Chem. Phys., 1977, 26, 1, 131, https://doi.org/10.1016/0301-0104(77)87099-7 . [all data]

Bondybey and Miller, 1979
Bondybey, V.E.; Miller, T.A., Laser induced fluorescence from fluorobenzene radical cations in the gas phase, J. Chem. Phys., 1979, 70, 1, 138, https://doi.org/10.1063/1.437231 . [all data]

Cossart-Magos, Cossart, et al., 1979, 2
Cossart-Magos, C.; Cossart, D.; Leach, S., Jahn---Teller effects in substituted benzene cations. II. Gas phase emission spectrum of 1, 3, 5-C6F3D+3 and comparison with 1, 3, 5-C6F3H+3, Chem. Phys., 1979, 41, 3, 345, https://doi.org/10.1016/0301-0104(79)80039-7 . [all data]

Dujardin, Leach, et al., 1980
Dujardin, G.; Leach, S.; Taieb, G., Fluorescence quantum yields and lifetimes of nine fluorobenzene cations. Electronic state relaxation processes, Chem. Phys., 1980, 46, 3, 407, https://doi.org/10.1016/0301-0104(80)85217-7 . [all data]

Maier and Thommen, 1981
Maier, J.P.; Thommen, F., Fluorescence quantum yields and lifetimes of fluorobenzene cations in selected levels of their B and C states determined by photoelectron-photoion coincidence spectroscopy, Chem. Phys., 1981, 57, 319. [all data]

Bondybey, Vaughn, et al., 1981
Bondybey, V.E.; Vaughn, C.; Miller, T.A.; English, J.H.; Shiley, R.H., Spectroscopy and decay dynamics of several methyl- and fluorine-substituted benzene radical cations, J. Am. Chem. Soc., 1981, 103, 21, 6303, https://doi.org/10.1021/ja00411a006 . [all data]


Notes

Go To: Top, Vibrational and/or electronic energy levels, References