Ethynyl radical
- Formula: C2H
- Molecular weight: 25.0293
- IUPAC Standard InChIKey: XEHVFKKSDRMODV-UHFFFAOYSA-N
- CAS Registry Number: 2122-48-7
- Chemical structure:
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Gas phase ion energetics data
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
L - Sharon G. Lias
Data compiled as indicated in comments:
B - John E. Bartmess
LL - Sharon G. Lias and Joel F. Liebman
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
View reactions leading to C2H+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 11.61 ± 0.07 | eV | N/A | N/A | L |
Quantity | Value | Units | Method | Reference | Comment |
Proton affinity (review) | 753. | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 720.8 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
2.9689 ± 0.0011 | N/A | Zhou, Garand, et al., 2007 | B |
2.9690 ± 0.0060 | LPES | Ervin and Lineberger, 1991 | B |
2.956 ± 0.020 | LPES | Taylor, Xu, et al., 1998 | B |
2.94 ± 0.10 | LPD | Janousek, Brauman, et al., 1979 | Adiabatic EA: 3.18±0.25 eV; B |
>2.30 ± 0.70 | EIAE | Thynne and MacNiel, 1971 | From C2H4; B |
3.730 ± 0.050 | PD | Feldman, 1970 | B |
2.10 ± 0.30 | EIAE | Locht and Momigny, 1970 | From C2H2, C2H4; B |
>2.79998 | EIAE | Trepka and Neuert, 1963 | From C2H4; B |
2.64955 | SI | Page and Goode, 1969 | The Magnetron method, lacking mass analysis, is not considered reliable.; B |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
11.61 ± 0.07 | DER | Norwood and Ng, 1989 | LL |
11.7 | DER | Lias, Bartmess, et al., 1988 | LL |
11.31 ± 0.13 | DER | Ono and Ng, 1981 | LLK |
11.51 | DER | Ono and Ng, 1981 | Unpublished result of S.I.Miller and J.Berkowitz; LLK |
11.96 ± 0.05 | DER | Okabe and Dibeler, 1973 | LLK |
11.96 ± 0.05 | DER | Dibeler, Walker, et al., 1973 | LLK |
11.6 ± 0.5 | EI | Wyatt and Stafford, 1972 | LLK |
Anion protonation reactions
C2H- + =
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1580. ± 20. | kJ/mol | AVG | N/A | Average of 8 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 1550. ± 20. | kJ/mol | AVG | N/A | Average of 7 values; Individual data points |
References
Go To: Top, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Zhou, Garand, et al., 2007
Zhou, J.; Garand, E.; Neumark, D.M.,
Vibronic structure in C2H and C2D from anion slow electron velocity-map imaging spectroscopy,
J. Chem. Phys., 2007, 127, 11, 114313, https://doi.org/10.1063/1.2768932
. [all data]
Ervin and Lineberger, 1991
Ervin, K.M.; Lineberger, W.C.,
Photoelectron Spectra of C2- and C2H-,
J. Phys. Chem., 1991, 95, 3, 1167, https://doi.org/10.1021/j100156a026
. [all data]
Taylor, Xu, et al., 1998
Taylor, T.R.; Xu, C.S.; Neumark, D.M.,
Photoelectron spectra of the C2nH- (n=1-4) and C2nD- (n=1-3) anions,
J. Chem. Phys., 1998, 108, 24, 10018-10026, https://doi.org/10.1063/1.476462
. [all data]
Janousek, Brauman, et al., 1979
Janousek, B.K.; Brauman, J.I.; Simons, J.,
An experimental and theoretical determination of the electron affinity of the enhynyl radical HC2,
J. Chem. Phys., 1979, 71, 2057. [all data]
Thynne and MacNiel, 1971
Thynne, J.C.J.; MacNiel, K.A.G.,
Negative ion formation by ethylene and 1,1-difluoroethylene,
J. Phys. Chem., 1971, 75, 2584. [all data]
Feldman, 1970
Feldman, D.,
Photoablosung von Elektronen bei einigen Stabilen Negativen Ionen,
Z. Naturfor., 1970, 25A, 621. [all data]
Locht and Momigny, 1970
Locht, R.; Momigny, J.,
Mass Spectrometric Determination of the Electron Affinities of Radicals,
Chem. Phys. Lett., 1970, 6, 4, 273, https://doi.org/10.1016/0009-2614(70)85072-2
. [all data]
Trepka and Neuert, 1963
Trepka, L.v.; Neuert, H.,
Uber die Entstehenung von Negativen Ionen aus einigen Kohlenwasserstoffen und Alkoholen durch Elektronenstoss,
Z. Naturfor., 1963, 18A, 1295. [all data]
Page and Goode, 1969
Page, F.M.; Goode, G.C.,
Negative Ions and the Magnetron., Wiley, NY, 1969. [all data]
Norwood and Ng, 1989
Norwood, K.; Ng, C.Y.,
A state-selected study of the unimolecular decompoisition of C2H2+(A,B) using the photoion photoelectron coincidence method,
J. Chem. Phys., 1989, 91, 2898. [all data]
Lias, Bartmess, et al., 1988
Lias, S.G.; Bartmess, J.E.; Liebman, J.F.; Holmes, J.L.; Levin, R.D.; Mallard, W.G.,
Gas-phase ion and neutral thermochemistry,
J. Phys. Chem. Ref. Data, Suppl. 1, 1988, 17, 1-861. [all data]
Ono and Ng, 1981
Ono, Y.; Ng, C.Y.,
The heat of formation of C2H+,
J. Chem. Phys., 1981, 74, 6985. [all data]
Okabe and Dibeler, 1973
Okabe, H.; Dibeler, V.H.,
Photon impact studies of C2HCN and CH3CN in the vacuum ultraviolet; heats of formation of C2H and CH3CN,
J. Chem. Phys., 1973, 59, 2430. [all data]
Dibeler, Walker, et al., 1973
Dibeler, V.H.; Walker, J.A.; McCulloh, K.E.,
Observations on hot bands in the molecular and dissociative photoionization of acetylene and the heat of formation of the ethynyl ion,
J. Chem. Phys., 1973, 59, 2264. [all data]
Wyatt and Stafford, 1972
Wyatt, J.R.; Stafford, F.E.,
Mass spectrometric determination of the heat of formation of ethynyl radical, C2H, and of some related species,
J. Phys. Chem., 1972, 76, 1913. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Symbols used in this document:
EA Electron affinity IE (evaluated) Recommended ionization energy ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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