C6H5OO

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   λmin 
 (nm) 		  λmax 
 (nm) 		  References
Tx gas A-X 495 531 Yu and Lin, 1994

State:   A
 Energy 
 (cm-1) 		  Med.   Transition   λmin 
 (nm) 		  λmax 
 (nm) 		  References
To = 7497 gas Just, Sharp, et al., 2006
Vib. 
sym. 		  No.   Approximate 
 type of mode 		  cm-1   Med.   Method   References
a' 14 OO stretch 944 gas CR Just, Sharp, et al., 2006
12 OO stretch 900 gas CR Just, Sharp, et al., 2006
23 COO bend 213 gas CR Just, Sharp, et al., 2006
a 33 CCO wag 53 gas CR Just, Sharp, et al., 2006

State:   X

Vib. 
sym. 		  No.   Approximate 
 type of mode 		  cm-1   Med.   Method   References
a' CH stretch 3189.1 Ar IR Mardyukov and Sander, 2009
CH stretch 3118.7 Ar IR Mardyukov and Sander, 2009
CH stretch 3089.3 Ar IR Mardyukov and Sander, 2009
CH stretch 3070.8 Ar IR Mardyukov and Sander, 2009
CH deform. 1481.2 m Ar IR Mardyukov and Sander, 2009
CH deform. 1463.9 w m Ar IR Mardyukov and Sander, 2009
1313.1 w Ar IR Mardyukov and Sander, 2009
OO stretch 1122.9 w m Ar IR Mardyukov and Sander, 2009
CH deform. 1067.7 w Ar IR Mardyukov and Sander, 2009
CH deform. 1018.5 w m Ar IR Mardyukov and Sander, 2009
793.9 w Ar IR Mardyukov and Sander, 2009
Ring deform. 615.1 w m Ar IR Mardyukov and Sander, 2009
COO deform. 607.2 w Ar IR Mardyukov and Sander, 2009
a CH wag 905.1 w m Ar IR Mardyukov and Sander, 2009
CH wag 751.9 vs Ar IR Mardyukov and Sander, 2009
CH wag 679.2 w m Ar IR Mardyukov and Sander, 2009
Ring deform. 480.8 w Ar IR Mardyukov and Sander, 2009

Notes

wWeak
mMedium
vsVery strong
oEnergy separation between the v = 0 levels of the excited and electronic ground states.
xEnergy separation between the band maximum of the excited electronic state and the v = 0 level of the ground state.

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.

Yu and Lin, 1994
Yu, T.; Lin, M.C., Kinetics of the C6H5 + O2 Reaction at Low Temperatures, J. Am. Chem. Soc., 1994, 116, 21, 9571, https://doi.org/10.1021/ja00100a022 . [all data]

Just, Sharp, et al., 2006
Just, G.M.P.; Sharp, E.N.; Zalyubovski, S.J.; Miller, T.A., Cavity ringdown spectroscopy of the electronic transition of the phenyl peroxy radical, Chem. Phys. Lett., 2006, 417, 4-6, 378, https://doi.org/10.1016/j.cplett.2005.10.036 . [all data]

Mardyukov and Sander, 2009
Mardyukov, A.; Sander, W., Matrix Isolation and Spectroscopic Characterization of the Phenylperoxy Radical and Its Rearranged Products, Chem. Eur. J., 2009, 15, 6, 1462, https://doi.org/10.1002/chem.200801546 . [all data]

Notes

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