1-Cyanoethyl radical
- Formula: C3H4N
- Molecular weight: 54.0706
- IUPAC Standard InChI: InChI=1S/C3H4N/c1-2-3-4/h2H,1H3
- IUPAC Standard InChIKey: VQGISNOMGHCEPX-UHFFFAOYSA-N
- CAS Registry Number: 3264-99-1
- Chemical structure:
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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 as indicated in comments:
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
B - John E. Bartmess
View reactions leading to C3H4N+ (ion structure unspecified)
Electron affinity determinations
| EA (eV) | Method | Reference | Comment |
|---|---|---|---|
| 1.766 ± 0.012 | LPES | Duan, Burggraf, et al., 2002 | B |
| 1.50 ± 0.10 | LPES | Nakajima, Taguwa, et al., 1995 | Vertical Detachment Energy: 1.71±0.10 eV; B |
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 9.8 ± 0.1 | EI | Pottie and Lossing, 1961 | RDSH |
References
Go To: Top, Gas phase ion energetics data, NIST Free Links, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Duan, Burggraf, et al., 2002
Duan, X.F.; Burggraf, L.W.; Weeks, D.E.; Davico, G.E.; Schwartz, R.L.; Lineberger, W.C.,
Photoelectron spectroscopy of Si2C3- and quantum chemistry of the linear Si2C3 cluster and its isomers,
J. Chem. Phys., 2002, 116, 9, 3601-3611, https://doi.org/10.1063/1.1427709
. [all data]
Nakajima, Taguwa, et al., 1995
Nakajima, A.; Taguwa, T.; Nakao, K.; Gomei, M.; Kishi, R.; Iwata, S.; Kaya, K.,
Photoelectron Spectroscopy of silicon-carbon cluster Anions (SinCm-),
J. Chem. Phys., 1995, 103, 6, 2050, https://doi.org/10.1063/1.469731
. [all data]
Pottie and Lossing, 1961
Pottie, R.F.; Lossing, F.P.,
Free radicals by mass spectrometry. XXV. Ionization potentials of cyanoalkyl radicals,
J. Am. Chem. Soc., 1961, 83, 4737. [all data]
Notes
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- Symbols used in this document:
EA Electron affinity - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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