2-Butynenitrile, 4,4,4-trifluoro-

Formula: C₄F₃N
Molecular weight: 119.0447
IUPAC Standard InChI: InChI=1S/C4F3N/c5-4(6,7)2-1-3-8
IUPAC Standard InChIKey: YZNFAKUUGQFZOK-UHFFFAOYSA-N
CAS Registry Number: 66051-48-7
Chemical structure:
This structure is also available as a 2d Mol file
Permanent link for this species. Use this link for bookmarking this species for future reference.
Information on this page:
Other data available:
- Mass spectrum (electron ionization)
Options:
- Switch to calorie-based units

Gas phase ion energetics data

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

IE (eV)	Method	Reference	Comment
12.00	PE	Asbrink, Svensson, et al., 1981
12.00 ± 0.02	PE	Bieri, Heilbronner, et al., 1979
12.26	PE	Asbrink, Svensson, et al., 1981	Vertical value

Go To: Top, Gas phase ion energetics data, Notes

Asbrink, Svensson, et al., 1981
Asbrink, L.; Svensson, A.; Von Niessen, W.; Bieri, G., 30.4 nm He(II) photoelectron spectra of organic molecules, J. Electron Spectrosc. Relat. Phenom., 1981, 24, 293. [all data]

Bieri, Heilbronner, et al., 1979
Bieri, G.; Heilbronner, E.; Hornung, V.; Kloster-Jensen, E.; Maier, J.P.; Thommen, F.; von Niessen, W., Electronic states of substituted haloacetylene and cyanoacetylene radical cations, Chem. Phys., 1979, 36, 1. [all data]

Go To: Top, Gas phase ion energetics data, References

Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
Customer support for NIST Standard Reference Data products.