C4-
- Formula: C4-
- Molecular weight: 48.0433
- CAS Registry Number: 59158-53-1
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Reaction thermochemistry data
Go To: Top, Vibrational and/or electronic energy levels, 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: John E. Bartmess
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
By formula: (C4- • 4294967295C) + C = C4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 676. ± 15. | kJ/mol | N/A | Arnold, Bradforth, et al., 1991 | gas phase; Linear structure for both anion and neutral. Bound state 37.063 kcal/mol up: Zhao, de Beer, et al., 1996 |
Vibrational and/or electronic energy levels
Go To: Top, Reaction thermochemistry 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: Marilyn E. Jacox
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
Td = 31320 ± 80 | gas | Yang, Taylor, et al., 1988 | |||||
Arnold, Bradforth, et al., 1991 | |||||||
Xu, Burton, et al., 1997 | |||||||
State: (3) 2Πu
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 28717 | gas | (3) 2Πu-X | 336 | 348 | Tulej, Kirkwood, et al., 1998 | ||
To = 28868 | Ne | 335 | 347 | Freivogel, Grutter, et al., 1997 | |||
State: (2) 2Πu
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 25989 | gas | (2) 2Πu-X | 372 | 384 | Tulej, Kirkwood, et al., 1998 | ||
To = 26069 ± 14 | Ne | 372 | 384 | Freivogel, Grutter, et al., 1997 | |||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 1 | 2056 | gas | MPD | Tulej, Kirkwood, et al., 1998 | ||
2 | 710 | gas | MPD | Tulej, Kirkwood, et al., 1998 | |||
2 | 755 ± 20 | Ne | AB | Freivogel, Grutter, et al., 1997 | |||
Πg | 4 | 374 | H | gas | MPD | Tulej, Kirkwood, et al., 1998 | |
4 | 349 ± 10 | H | Ne | AB | Freivogel, Grutter, et al., 1997 | ||
Πu | 5 | 268 | H | gas | MPD | Tulej, Kirkwood, et al., 1998 | |
5 | 271 ± 10 | H | Ne | AB | Freivogel, Grutter, et al., 1997 | ||
State: C
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 21871.53 | gas | C-X | 379 | 460 | Zhao, de Beer, et al., 1996, 2 | ||
Tulej, Kirkwood, et al., 1998 | |||||||
To = 21896 ± 5 | Ne | C-X | 410 | 527 | Freivogel, Fulara, et al., 1995 | ||
Schafer, Grutter, et al., 1996 | |||||||
To = 21720 | Ar | C-X | 416 | 461 | Grutter, Freivogel, et al., 1997 | ||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 1 | 1729 | H | gas | MPD | Tulej, Kirkwood, et al., 1998 | |
1 | 1801 | Ne | AB | Fulara, Freivogel, et al., 2007 | |||
2 | 752.4 | gas | PD | Zhao, de Beer, et al., 1996, 2 | |||
2 | 759 ± 5 | Ne | AB | Freivogel, Fulara, et al., 1995 | |||
2 | 763 | Ar | AB | Grutter, Freivogel, et al., 1997 | |||
Πu | 5 | Deformation | 223 | H | gas | PD | Zhao, de Beer, et al., 1996, 2 |
5 | Deformation | 242 | H | Ne | AB | Fulara, Freivogel, et al., 2007 | |
State: B
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 10789 ± 2 | Ne | B-X | 672 | 927 | Freivogel, Grutter, et al., 1997 | ||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 1 | 2056 ± 5 | Ne | AB | Freivogel, Grutter, et al., 1997 | ||
2 | 930 ± 4 | Ne | AB | Freivogel, Grutter, et al., 1997 | |||
Πu | 5 | 259 ± 2 | H | Ne | AB | Freivogel, Grutter, et al., 1997 | |
State: A
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
Ne | A-X | 907 | 1206 | Freivogel, Grutter, et al., 1997 | |||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 2 | 817 ± 3 | Ne | AB | Freivogel, Grutter, et al., 1997 | ||
Πu | 5 | 275 ± 2 | Ne | AB | Freivogel, Grutter, et al., 1997 | ||
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 1 | 2047 ± 20 | Ne | LF | Schafer, Grutter, et al., 1996 | ||
2 | 936 ± 20 | Ne | LF | Schafer, Grutter, et al., 1996 | |||
Σu+ | 3 | Asym. stretch | 1699.8 | Ar | IR | Szczepanski, Vala, et al., 1997 | |
Πg | 4 | Deformation | 396 ± 20 | H | Ne | LF | Schafer, Grutter, et al., 1996 |
Additional references: Jacox, 1994, page 183; Jacox, 1998, page 246; Jacox, 2003, page 217
Notes
H | (1/2)(2ν) |
o | Energy separation between the v = 0 levels of the excited and electronic ground states. |
d | Photodissociation threshold |
References
Go To: Top, Reaction thermochemistry data, Vibrational and/or electronic energy levels, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Arnold, Bradforth, et al., 1991
Arnold, D.W.; Bradforth, S.E.; Kitsopoulos, T.N.; Neumark, D.M.,
Vibrationally Resolved Spectra of C2-C11 by Anion Photoelectron Spectroscopy,
J. Chem. Phys., 1991, 95, 12, 8753, https://doi.org/10.1063/1.461211
. [all data]
Zhao, de Beer, et al., 1996
Zhao, Y.; de Beer, E.; Xu, C.; Taylor, T.; Neumark, D.M.,
Spectroscopy and Electron Detachment Dynamics of C4-, C6- and C8-,
J. Chem. Phys., 1996, 105, 12, 4905, https://doi.org/10.1063/1.472341
. [all data]
Yang, Taylor, et al., 1988
Yang, S.; Taylor, K.J.; Craycraft, M.J.; Conceicao, J.; Pettiette, C.L.; Cheshnovsky, O.; Smalley, R.E.,
UPS of 2--30-atom carbon clusters: Chains and rings,
Chem. Phys. Lett., 1988, 144, 5-6, 431, https://doi.org/10.1016/0009-2614(88)87291-9
. [all data]
Xu, Burton, et al., 1997
Xu, C.; Burton, G.R.; Taylor, T.R.; Neumark, D.M.,
Photoelectron spectroscopy of C[sub 4][sup -], C[sub 6][sup -], and C[sub 8][sup -],
J. Chem. Phys., 1997, 107, 9, 3428, https://doi.org/10.1063/1.474715
. [all data]
Tulej, Kirkwood, et al., 1998
Tulej, M.; Kirkwood, D.A.; Maccaferri, G.; Dopfer, O.; Maier, J.P.,
Electronic spectra of linear carbon anions,
Chem. Phys., 1998, 228, 1-3, 293, https://doi.org/10.1016/S0301-0104(97)00358-3
. [all data]
Freivogel, Grutter, et al., 1997
Freivogel, P.; Grutter, M.; Forney, D.; Maier, J.P.,
Electronic absorption spectra of C[sub 4][sup -] and C[sub 6][sup -] chains in neon matrices,
J. Chem. Phys., 1997, 107, 1, 22, https://doi.org/10.1063/1.474369
. [all data]
Zhao, de Beer, et al., 1996, 2
Zhao, Y.; de Beer, E.; Neumark, D.M.,
Rotationally resolved spectrum of the C 2Πu←X 2Πg electronic transition of C-4 via resonant two-photon detachment spectroscopy,
J. Chem. Phys., 1996, 105, 7, 2575, https://doi.org/10.1063/1.472123
. [all data]
Freivogel, Fulara, et al., 1995
Freivogel, P.; Fulara, J.; Jakobi, M.; Forney, D.; Maier, J.P.,
Electronic absorption spectra of linear carbon chains in neon matrices. II. C-2n, C2n, and C2nH,
J. Chem. Phys., 1995, 103, 1, 54, https://doi.org/10.1063/1.469621
. [all data]
Schafer, Grutter, et al., 1996
Schafer, M.; Grutter, M.; Fulara, J.; Forney, D.; Freivogel, P.; Maier, J.P.,
Emission spectrum of mass-selected C4-:C2Πu → X2Πg in a neon matrix,
Chem. Phys. Lett., 1996, 260, 3-4, 406, https://doi.org/10.1016/0009-2614(96)00882-2
. [all data]
Grutter, Freivogel, et al., 1997
Grutter, M.; Freivogel, P.; Forney, D.; Maier, J.P.,
Diffusion of mass-selected carbon atoms and molecules in argon and neon matrices,
J. Chem. Phys., 1997, 107, 14, 5356, https://doi.org/10.1063/1.474245
. [all data]
Fulara, Freivogel, et al., 2007
Fulara, J.; Freivogel, P.; Maier, J.P.,
Electronic Transitions of CsC,
J. Phys. Chem. A, 2007, 111, 31, 7551, https://doi.org/10.1021/jp070356y
. [all data]
Szczepanski, Vala, et al., 1997
Szczepanski, J.; Vala, M.; Shen, L.N.; Withey, P.A.; Graham, W.R.,
Infrared Spectroscopy of the C,
J. Phys. Chem. A, 1997, 101, 47, 8788, https://doi.org/10.1021/jp971884k
. [all data]
Jacox, 1994
Jacox, M.E.,
Vibrational and electronic energy levels of polyatomic transient molecules, American Chemical Society, Washington, DC, 1994, 464. [all data]
Jacox, 1998
Jacox, M.E.,
Vibrational and electronic energy levels of polyatomic transient molecules: supplement A,
J. Phys. Chem. Ref. Data, 1998, 27, 2, 115-393, https://doi.org/10.1063/1.556017
. [all data]
Jacox, 2003
Jacox, M.E.,
Vibrational and electronic energy levels of polyatomic transient molecules: supplement B,
J. Phys. Chem. Ref. Data, 2003, 32, 1, 1-441, https://doi.org/10.1063/1.1497629
. [all data]
Notes
Go To: Top, Reaction thermochemistry data, Vibrational and/or electronic energy levels, References
- Symbols used in this document:
ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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