HCCCH2OO

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:   A
 Energy 
 (cm-1) 		  Med.   Transition   λmin 
 (nm) 		  λmax 
 (nm) 		  References
To = 7631.8 gas Thomas, Kline, et al., 2010

State:   X

Vib. 
sym. 		  No.   Approximate 
 type of mode 		  cm-1   Med.   Method   References
a' 1 CH stretch 3326 ± 3 Ar IR Jochnowitz, Zhang, et al., 2010
2 CH2 s-stretch 2960 ± 3 Ar IR Jochnowitz, Zhang, et al., 2010
3 CC stretch 2148 Ar IR Jochnowitz, Zhang, et al., 2010
4 CH2 scissor 1440 Ar IR Jochnowitz, Zhang, et al., 2010
5 CH2 wag 1338 Ar IR Jochnowitz, Zhang, et al., 2010
6 O-O stretch 1127 Ar IR Jochnowitz, Zhang, et al., 2010
7 C-C stretch 982 Ar IR Jochnowitz, Zhang, et al., 2010
8 O-C stretch 928 ± 3 Ar IR Jochnowitz, Zhang, et al., 2010
9 HCC deform. 684 Ar IR Jochnowitz, Zhang, et al., 2010
10 OCC bend 499 Ar IR Jochnowitz, Zhang, et al., 2010
a 14 CH2 twist 1218 Ar IR Jochnowitz, Zhang, et al., 2010
15 CH2 rock 972 Ar IR Jochnowitz, Zhang, et al., 2010
16 HCC deform. 637 Ar IR Jochnowitz, Zhang, et al., 2010

Notes

oEnergy separation between the v = 0 levels of the excited and electronic ground states.

References

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

Thomas, Kline, et al., 2010
Thomas, P.S.; Kline, N.D.; Miller, T.A., J. Phys. Chem. A, 2010, 114, 47, 12437, https://doi.org/10.1021/jp108158a . [all data]

Jochnowitz, Zhang, et al., 2010
Jochnowitz, E.B.; Zhang, X.; Nimlos, M.R.; Flowers, B.A.; Stanton, J.F.; Ellison, G.B., Infrared Spectrum of the Propargyl Peroxyl Radical, HC≡C---CH, J. Phys. Chem. A, 2010, 114, 3, 1498, https://doi.org/10.1021/jp907806g . [all data]

Notes

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