1,2,3-Trioxolane
- Formula: C2H4O3
- Molecular weight: 76.0514
- IUPAC Standard InChIKey: MAAKQSASDHJHIR-UHFFFAOYSA-N
- CAS Registry Number: 6669-36-9
- Chemical structure:
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Vibrational and/or electronic energy levels
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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 by: Marilyn E. Jacox
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
CH2 deform. | 1214 | m | Xe | IR | Kohlmiller and Andrews, 1981 | ||
CO st., CH2def. | 983 | s | Xe | IR | Kohlmiller and Andrews, 1981 | ||
CO st., CH2def. | 982 | CO2 | IR | Nelander and Nord, 1977 Kohlmiller and Andrews, 1981 | |||
CO stretch | 927 | s | Xe | IR | Kohlmiller and Andrews, 1981 | ||
CO stretch | 926 | CO2 | IR | Nelander and Nord, 1977 Kohlmiller and Andrews, 1981 | |||
O3 s-stretch | 846 | w m | Xe | IR | Kohlmiller and Andrews, 1981 | ||
COO def.,CO st. | 727 | vs | Xe | IR | Kohlmiller and Andrews, 1981 | ||
COO def.,CO st. | 726 | CO2 | IR | Nelander and Nord, 1977 Kohlmiller and Andrews, 1981 | |||
O3 a-stretch | 647 | vs | Xe | IR | Kohlmiller and Andrews, 1981 | ||
O3 a-stretch | 648 | CO2 | IR | Nelander and Nord, 1977 Kohlmiller and Andrews, 1981 | |||
O3 bend | 409 | m | Xe | IR | Kohlmiller and Andrews, 1981 | ||
O3 bend | 406 | CO2 | IR | Nelander and Nord, 1977 Kohlmiller and Andrews, 1981 | |||
Additional references: Jacox, 1994, page 422; Jacox, 1998, page 366; Zozom, Gillies, et al., 1987; Gillies, Gillies, et al., 1988
Notes
w | Weak |
m | Medium |
s | Strong |
vs | Very strong |
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.
Kohlmiller and Andrews, 1981
Kohlmiller, C.K.; Andrews, L.,
Infrared spectrum of the primary ozonide of ethylene in solid xenon,
J. Am. Chem. Soc., 1981, 103, 10, 2578, https://doi.org/10.1021/ja00400a016
. [all data]
Nelander and Nord, 1977
Nelander, B.; Nord, L.,
Tetrahedron Lett., 1977, 2821. [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]
Zozom, Gillies, et al., 1987
Zozom, J.; Gillies, C.W.; Suenram, R.D.; Lovas, F.J.,
Microwave detection of the primary ozonide of ethylene in the gas phase,
Chem. Phys. Lett., 1987, 140, 1, 64, https://doi.org/10.1016/0009-2614(87)80418-9
. [all data]
Gillies, Gillies, et al., 1988
Gillies, J.Z.; Gillies, C.W.; Suenram, R.D.; Lovas, F.J.,
The ozonolysis of ethylene. Microwave spectrum, molecular structure, and dipole moment of ethylene primary ozonide (1,2,3-trioxolane),
J. Am. Chem. Soc., 1988, 110, 24, 7991, https://doi.org/10.1021/ja00232a007
. [all data]
Notes
Go To: Top, Vibrational and/or electronic energy levels, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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