CD3CN+


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 = 23720 ± 320 gas Lake and Thompson, 1970

State:   A


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

To = 7340 ± 320 gas Lake and Thompson, 1970


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

a1 3 CD3 umbrella 970 ± 80 gas PE Lake and Thompson, 1970
Turner, 1970

State:   X


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

a1 2 CN stretch 2029 ± 3 gas PE TPE Lake and Thompson, 1970
Turner, 1970
Yang, Zhou, et al., 2005
3 CD3 umbrella 1070 ± 80 gas PE Turner, 1970
4 C-C stretch 825 ± 3 gas PE TPE Turner, 1970
Yang, Zhou, et al., 2005
e 6 CD3 deform. 943 ± 3 gas TPE Yang, Zhou, et al., 2005
8 CCN deform. 317 ± 3 gas TPE Yang, Zhou, et al., 2005
8 CCN deform. 196 ± 5 gas TPE Yang, Zhou, et al., 2005

Notes

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.

Lake and Thompson, 1970
Lake, R.F.; Thompson, H., The photoelectron spectra of some molecules containing the C N group, Proc. Roy. Soc. (London), 1970, A317, 187. [all data]

Turner, 1970
Turner, D.W., Molecular Photoelectron Spectroscopy, Phil. Trans. Roy. Soc. (London) A268, 1970, 268, 1184, 7, https://doi.org/10.1098/rsta.1970.0059 . [all data]

Yang, Zhou, et al., 2005
Yang, J.; Zhou, C.; Mo, Y., The Jahn-Teller Effect in CH, J. Phys. Chem. A, 2005, 109, 44, 9964, https://doi.org/10.1021/jp054366f . [all data]


Notes

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