Dibromomethylene
- Formula: CBr2
- Molecular weight: 171.819
- IUPAC Standard InChIKey: WNLFIUJNNYMFIZ-UHFFFAOYSA-N
- CAS Registry Number: 4371-77-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Vibrational and/or electronic energy levels
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 compiled by: Marilyn E. Jacox
State: A
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 15279 | gas | A-X | 525 | 1011 | Zhou, Zhan, et al., 1990 | ||
Xu and Harmony, 1993 | |||||||
Lee, Liu, et al., 2003 | |||||||
Hsu, Chang, et al., 2005 | |||||||
Tao, Mukarakate, et al., 2006 | |||||||
Tao, Mukarakate, et al., 2007 | |||||||
Tao, Mukarakate, et al., 2007, 2 | |||||||
Al-Samra and Western, 2010 | |||||||
To = 15158 | Ar | A-X | 600 | 857 | Tevault and Andrews, 1975 | ||
Bondybey and English, 1980 | |||||||
Tao, Mukarakate, et al., 2006 | |||||||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
a1 | 1 | Sym. stretch | 473.6 ± 0.4 | gas | LF | Zhou, Zhan, et al., 1990 Xu and Harmony, 1993 Tao, Mukarakate, et al., 2007, 2 | |
1 | Sym. stretch | 468 | Ar | LF | Bondybey and English, 1980 | ||
2 | Bend | 185.2 | gas | LF | Zhou, Zhan, et al., 1990 Xu and Harmony, 1993 Tao, Mukarakate, et al., 2007, 2 | ||
2 | Bend | 186 | Ar | LF | Bondybey and English, 1980 | ||
State: a
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = >15330 | gas | Wren, Vogelhuber, et al., 2009 | |||||
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
a1 | 1 | Sym. stretch | 598 | gas | LF | Xu and Harmony, 1993 Lee, Liu, et al., 2003 Hsu, Chang, et al., 2005 Wren, Vogelhuber, et al., 2009 | |
1 | Sym. stretch | 595 | w | Ar | IR | Andrews and Carver, 1968 Rogers, Abramowitz, et al., 1970 | |
2 | Bend | 194 | w | gas | LF | Lee, Liu, et al., 2003 Hsu, Chang, et al., 2005 Wren, Vogelhuber, et al., 2009 | |
2 | Bend | 196 | Ar | LF | Tevault and Andrews, 1975 Bondybey and English, 1980 | ||
b2 | 3 | Asym. stretch | 660 ± 5 | gas | LF | Hsu, Chang, et al., 2005 | |
3 | Asym. stretch | 641 | s | Ar | IR | Andrews and Carver, 1968 Rogers, Abramowitz, et al., 1970 | |
Additional references: Jacox, 1994, page 100; Jacox, 2003, page 139
Notes
w | Weak |
s | Strong |
o | Energy separation between the v = 0 levels of the excited and electronic ground states. |
References
Go To: Top, 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.
Zhou, Zhan, et al., 1990
Zhou, S.K.; Zhan, M.S.; Shi, J.L.; Wang, C.X.,
Gas phase spectrum of dibromocarbene studied by laser-induced fluorescence,
Chem. Phys. Lett., 1990, 166, 5-6, 547, https://doi.org/10.1016/0009-2614(90)87149-L
. [all data]
Xu and Harmony, 1993
Xu, S.; Harmony, M.D.,
LIF excitation spectrum of dibromocarbene in a supersonic free-jet expansion,
J. Phys. Chem., 1993, 97, 29, 7465, https://doi.org/10.1021/j100131a013
. [all data]
Lee, Liu, et al., 2003
Lee, C.-L.; Liu, M.-L.; Chang, B.-C.,
Electronic spectroscopy of bromomethylenes in a supersonic free jet expansion,
Phys. Chem. Chem. Phys., 2003, 5, 18, 3859, https://doi.org/10.1039/b307449h
. [all data]
Hsu, Chang, et al., 2005
Hsu, H.-J.; Chang, W.-Z.; Chang, B.-C.,
Dispersed fluorescence spectroscopy of the CBr2Ã1B1--X1A1 transition,
Phys. Chem. Chem. Phys., 2005, 7, 12, 2468, https://doi.org/10.1039/b505434f
. [all data]
Tao, Mukarakate, et al., 2006
Tao, C.; Mukarakate, C.; Brusse, D.; Mishchenko, Y.; Reid, S.A.,
Reassignment of the electronic origin in the system of dibromocarbene,
J. Mol. Spectrosc., 2006, 240, 1, 139, https://doi.org/10.1016/j.jms.2006.09.006
. [all data]
Tao, Mukarakate, et al., 2007
Tao, C.; Mukarakate, C.; Reid, S.A.,
Single vibronic level emission spectroscopy of the system of dibromocarbene,
J. Mol. Spectrosc., 2007, 241, 2, 136, https://doi.org/10.1016/j.jms.2006.11.009
. [all data]
Tao, Mukarakate, et al., 2007, 2
Tao, C.; Mukarakate, C.; Brusse, D.; Mishchenko, Y.; Reid, S.A.,
Electronic spectroscopy, lifetimes, and barrier to linearity in the system of dibromocarbene,
J. Mol. Spectrosc., 2007, 241, 2, 180, https://doi.org/10.1016/j.jms.2006.12.005
. [all data]
Al-Samra and Western, 2010
Al-Samra, E.H.; Western, C.M.,
High resolution spectroscopy of the Ã1B1--A1 transition of CBr2,
J. Mol. Spectrosc., 2010, 260, 2, 135, https://doi.org/10.1016/j.jms.2010.02.001
. [all data]
Tevault and Andrews, 1975
Tevault, D.E.; Andrews, L.,
Laser-induced fluorescence studies of alkali metal atom-carbon tetrahalide matrix reaction products. Fluorescence spectra of dibromome thylene and bromochloromethylene in solid argon at 15.deg.K,
J. Am. Chem. Soc., 1975, 97, 7, 1707, https://doi.org/10.1021/ja00840a014
. [all data]
Bondybey and English, 1980
Bondybey, V.E.; English, J.H.,
Laser excitation spectra and lifetimes of CBrCl and CBr2 in solid Ar,
J. Mol. Spectrosc., 1980, 79, 2, 416, https://doi.org/10.1016/0022-2852(80)90222-2
. [all data]
Wren, Vogelhuber, et al., 2009
Wren, S.W.; Vogelhuber, K.M.; Ervin, K.M.; Lineberger, W.C.,
The photoelectron spectrum of CCl2-: the convergence of theory and experiment after a decade of debate,
Phys. Chem. Chem. Phys., 2009, 11, 23, 4745, https://doi.org/10.1039/b822690c
. [all data]
Andrews and Carver, 1968
Andrews, L.; Carver, T.G.,
Reactions of Alkali-Metal Atoms with Carbon Tetrabromide. Infrared Spectra and Bonding in the Tribromomethyl Radical and Dibromocarbene in Solid Argon,
J. Chem. Phys., 1968, 49, 2, 896, https://doi.org/10.1063/1.1670158
. [all data]
Rogers, Abramowitz, et al., 1970
Rogers, E.E.; Abramowitz, S.; Jacox, M.E.; Milligan, D.E.,
Matrix-Isolation Studies of the Infrared Spectra of the Free Radicals CCl3 and CBr3,
J. Chem. Phys., 1970, 52, 5, 2198, https://doi.org/10.1063/1.1673285
. [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, 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, Vibrational and/or electronic energy levels, 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.