CaNC

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:   D
 Energy 
 (cm-1) 		  Med.   Transition   λmin 
 (nm) 		  λmax 
 (nm) 		  References
To = 31515 gas D-X 298 317 Greetham and Ellis, 2000
Vib. 
sym. 		  No.   Approximate 
 type of mode 		  cm-1   Med.   Method   References
a' 2 Bend 175 gas LF Greetham and Ellis, 2000
3 CaN stretch 480 gas LF Greetham and Ellis, 2000

State:   C
 Energy 
 (cm-1) 		  Med.   Transition   λmin 
 (nm) 		  λmax 
 (nm) 		  References
gas C-X 385 418 Pasternack and Dagdigian, 1976

State:   A
 Energy 
 (cm-1) 		  Med.   Transition   λmin 
 (nm) 		  λmax 
 (nm) 		  References
To = 16229.54 gas A-X 572 670 Pasternack and Dagdigian, 1976
Furio and Dagdigian, 1985
Ellingboe, Bopegedera, et al., 1986
Whitham, Soep, et al., 1990
Douay and Bernath, 1990
Steimle, Fletcher, et al., 1992
Scurlock, Fletcher, et al., 1994

State:   X

Vib. 
sym. 		  No.   Approximate 
 type of mode 		  cm-1   Med.   Method   References
Σ+ 1 NC stretch 2058.4 Ar IR Lanzisera and Andrews, 1997
3 CaN stretch 403 Ar IR Lanzisera and Andrews, 1997

Additional references: Jacox, 1994, page 62; Jacox, 1998, page 164; Jacox, 2003, page 59; Steimle, Saito, et al., 1993; Scurlock, Steimle, et al., 1994

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.

Greetham and Ellis, 2000
Greetham, G.M.; Ellis, A.M., Ultraviolet laser spectroscopy of jet-cooled CaNC and SrNC free radicals: Observation of bent excited electronic states, J. Chem. Phys., 2000, 113, 20, 8945, https://doi.org/10.1063/1.1319344 . [all data]

Pasternack and Dagdigian, 1976
Pasternack, L.; Dagdigian, P.J., Laser-fluorescence study of the reactions of alkaline earth atoms with BrCN: Spectroscopic observation of the alkaline earth monocyanides, J. Chem. Phys., 1976, 65, 4, 1320, https://doi.org/10.1063/1.433228 . [all data]

Furio and Dagdigian, 1985
Furio, N.; Dagdigian, P.J., Chemiluminescence study of the Ca(1D) + BrCN reaction: Estimate of the CaCN dissociation energy, Chem. Phys. Lett., 1985, 115, 4-5, 358, https://doi.org/10.1016/0009-2614(85)85148-4 . [all data]

Ellingboe, Bopegedera, et al., 1986
Ellingboe, L.C.; Bopegedera, A.M.R.P.; Brazier, C.R.; Bernath, P.F., Laser spectroscopy of calcium and strontium monocyanates, Chem. Phys. Lett., 1986, 126, 3-4, 285, https://doi.org/10.1016/S0009-2614(86)80084-7 . [all data]

Whitham, Soep, et al., 1990
Whitham, C.J.; Soep, B.; Visticot, J.-P.; Keller, A., Observation and spectroscopy of metallic free radicals produced by reactive collisions during a supersonic expansion, J. Chem. Phys., 1990, 93, 2, 991, https://doi.org/10.1063/1.459126 . [all data]

Douay and Bernath, 1990
Douay, M.; Bernath, P.F., Laser spectroscopy of CaNC and SrNC, Chem. Phys. Lett., 1990, 174, 3-4, 230, https://doi.org/10.1016/0009-2614(90)85337-C . [all data]

Steimle, Fletcher, et al., 1992
Steimle, T.C.; Fletcher, D.A.; Jung, K.Y.; Scurlock, C.T., Molecular beam optical Stark spectroscopy of calcium monocyanide, J. Chem. Phys., 1992, 97, 5, 2909, https://doi.org/10.1063/1.463032 . [all data]

Scurlock, Fletcher, et al., 1994
Scurlock, C.T.; Fletcher, D.A.; Steimle, T.C., An analysis of the A 2Π--X 2Σ+ band system of isotopically substituted calcium isocyanide CaNC, J. Chem. Phys., 1994, 101, 9, 7255, https://doi.org/10.1063/1.468283 . [all data]

Lanzisera and Andrews, 1997
Lanzisera, D.V.; Andrews, L., Reactions of Laser-Ablated Mg, Ca, Sr, and Ba Atoms with Hydrogen Cyanide in Excess Argon. Matrix Infrared Spectra and Density Functional Calculations on Novel Isocyanide Products, J. Phys. Chem. A, 1997, 101, 50, 9666, https://doi.org/10.1021/jp972098i . [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]

Jacox, 1998
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement A, J. Phys. Chem. Ref. Data, 1998, 27, 2, 115-393, https://doi.org/10.1063/1.556017 . [all data]

Jacox, 2003
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement B, J. Phys. Chem. Ref. Data, 2003, 32, 1, 1-441, https://doi.org/10.1063/1.1497629 . [all data]

Steimle, Saito, et al., 1993
Steimle, T.C.; Saito, S.; Takano, S., Laboratory measurements of the millimeter-wave spectra of calcium isocyanide, Astrophys. J., 1993, 410, L49, https://doi.org/10.1086/186877 . [all data]

Scurlock, Steimle, et al., 1994
Scurlock, C.T.; Steimle, T.C.; Suenram, R.D.; Lovas, F.J., The pure rotational spectrum of CaNC, J. Chem. Phys., 1994, 100, 5, 3497, https://doi.org/10.1063/1.466391 . [all data]

Notes

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