1,3,5-Hexatriene

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Phase change data

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), References, Notes

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

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director

Quantity Value Units Method Reference Comment
Tboil353. ± 3.KAVGN/AAverage of 14 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus261.45KN/AWoods and Schwartzman, 1948Uncertainty assigned by TRC = 0.3 K; TRC

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Gas phase ion energetics data

Go To: Top, Phase change data, Mass spectrum (electron ionization), References, Notes

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

Data compiled by: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

View reactions leading to C6H8+ (ion structure unspecified)

Ionization energy determinations

IE (eV) Method Reference
8.42 ± 0.05EIFranklin and Carroll, 1969
8.27 ± 0.05SPrice, 1946

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C4H2+16.46 ± 0.15C2H2+2H2EIFranklin and Carroll, 1969 
C4H3+16.54 ± 0.15C2H2+H2+H?EIFranklin and Carroll, 1969 
C4H4+12.82 ± 0.10C2H2+H2EIFranklin and Carroll, 1969 
C4H5+13.60 ± 0.10C2H2+HEIFranklin and Carroll, 1969 
C4H6+12.25 ± 0.30C2H2EIFranklin and Carroll, 1969 
C5H3+14.95 ± 0.15CH3+H2?EIFranklin and Carroll, 1969 
C5H5+12.25 ± 0.10CH3EIFranklin and Carroll, 1969 
C6H5+13.11 ± 0.10H2+HEIFranklin and Carroll, 1969 
C6H6+10.77 ± 0.10H2EIFranklin and Carroll, 1969 
C6H7+9.96 ± 0.15HEIFranklin and Carroll, 1969 

Mass spectrum (electron ionization)

Go To: Top, Phase change data, Gas phase ion energetics data, References, Notes

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

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Mass spectrum
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Collection (C) 2014 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
NIST MS number 411

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References

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes

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

Woods and Schwartzman, 1948
Woods, G.F.; Schwartzman, L.H., 1,3,5-Hexatriene, J. Am. Chem. Soc., 1948, 70, 3394. [all data]

Franklin and Carroll, 1969
Franklin, J.L.; Carroll, S.R., Effect of molecular structure on ionic decomposition. II. An electron-impact study of 1,3-and 1,4-cyclohexadiene and 1,3,5-hexatriene, J. Am. Chem. Soc., 1969, 91, 6564. [all data]

Price, 1946
Price, W.C., The absorption spectra of hexatriene and divinyl acetylene in the vacuum ultraviolet, Proc. Roy. Soc. (London) Al, 1946, 85, 182. [all data]


Notes

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), References