Methyl isocyanide-d3


Gas phase ion energetics data

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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: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

IE (eV) Method Reference
11.25PELake and Thompson, 1971

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: Takehiko Shimanouchi

Symmetry:   C     Symmetry Number σ = 3


 Sym.   No   Approximate   Selected Freq.  Infrared   Raman   Comments 
 Species   type of mode   Value   Rating   Value  Phase  Value  Phase

a1 1 CD3 s-str 2251  B 2250.6 W gas
a1 2 NC str 2165  B 2165.0 W gas
a1 3 CD3 s-deform 1117  B 1117.4 W gas
a1 4 CN str 877  B 876.7 M gas
e 5 CD3 d-str 2263  B 2262.9 S gas
e 6 CD3 d-deform 1058  B 1058.2 S gas
e 7 CD3 rock 900  B 900.1 S gas
e 8 CNC bend 249  C OC28)

Source: Shimanouchi, 1972

Notes

SStrong
MMedium
WWeak
OCFrequency estimated from an overtone or a combination tone indicated in the parentheses.
B1~3 cm-1 uncertainty
C3~6 cm-1 uncertainty

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.

Lake and Thompson, 1971
Lake, R.F.; Thompson, H.W., The photoelectron spectra of methyl isocyanide and trideuteromethyl isocyanide, Spectrochim. Acta, 1971, 27A, 783. [all data]

Shimanouchi, 1972
Shimanouchi, T., Tables of Molecular Vibrational Frequencies Consolidated Volume I, National Bureau of Standards, 1972, 1-160. [all data]


Notes

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