uranium dioxide
- Formula: O2U
- Molecular weight: 270.0277
- CAS Registry Number: 1344-57-6
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Condensed phase thermochemistry data
Go To: Top, Gas phase ion energetics data, 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.
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°solid | -259.32 ± 0.24 | kcal/mol | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
Quantity | Value | Units | Method | Reference | Comment |
S°solid,1 bar | 18.41 ± 0.048 | cal/mol*K | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
Gas phase ion energetics data
Go To: Top, Condensed phase thermochemistry data, 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 as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
5.4 ± 0.1 | EI | Rauh and Ackermann, 1974 | LLK |
4.5 ± 1.5 | EI | Blackburn and Danielson, 1972 | LLK |
5.5 ± 0.4 | EI | Pattoret, Drowart, et al., 1968 | RDSH |
5.5 ± 0.1 | EI | Mann, 1964 | RDSH |
4.3 ± 0.6 | EI | DeMaria, Burns, et al., 1960 | RDSH |
Vibrational and/or electronic energy levels
Go To: Top, Condensed phase thermochemistry data, Gas phase ion energetics 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: 2g
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 31838 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Πu | 2 | Bend | 71 ± 10 | gas | MPI | Han, Goncharov, et al., 2004 | |
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 29700 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 27259 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 27120 | Ar | Lue, Jin, et al., 2004 | |||||
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 18423 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
State: ?
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 18159 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
State: 4g
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 17859 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Πu | 2 | Bend | 80 | T | gas | MPI | Han, Goncharov, et al., 2004 |
State: 3D1u
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 1401 | Ar | Lue, Jin, et al., 2004 | |||||
State: 3D2u
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 1094 | Ar | Lue, Jin, et al., 2004 | |||||
State: 3F3u
Energy (cm-1) |
Med. | Transition | λmin (nm) |
λmax (nm) |
References | ||
---|---|---|---|---|---|---|---|
To = 360 ± 5 | gas | Han, Goncharov, et al., 2004 | |||||
To = 408 | Ar | Lue, Jin, et al., 2004 | |||||
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Πu | 2 | Bend | 135 ± 10 | gas | MPI | Han, Goncharov, et al., 2004 | |
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Σg+ | 1 | Sym. stretch | 771 ± 10 | Ar | IR LF | Gabelnick, Reedy, et al., 1973 Lue, Jin, et al., 2004 | |
Πu | 2 | Bend | 121 ± 10 | gas | MPI | Han, Goncharov, et al., 2004 | |
2 | Bend | 225.2 | Ar | IR | Green, Reedy, et al., 1980 | ||
Σu+ | 3 | Asym. stretch | 914.8 | Ne | IR | Sankaran, Sundararajan, et al., 1999 | |
3 | Asym. stretch | 776.1 | Ar | IR | Gabelnick, Reedy, et al., 1973 Hunt and Andrews, 1993 Sankaran, Sundararajan, et al., 1999 Zhou, Andrews, et al., 2000 | ||
3 | Asym. stretch | 768.0 | Kr | IR | Gabelnick, Reedy, et al., 1973 | ||
Additional references: Jacox, 1998, page 179; Jacox, 2003, page 110
Notes
T | Tentative assignment or approximate value |
o | Energy separation between the v = 0 levels of the excited and electronic ground states. |
References
Go To: Top, Condensed phase thermochemistry data, Gas phase ion energetics 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.
Cox, Wagman, et al., 1984
Cox, J.D.; Wagman, D.D.; Medvedev, V.A.,
CODATA Key Values for Thermodynamics, Hemisphere Publishing Corp., New York, 1984, 1. [all data]
Rauh and Ackermann, 1974
Rauh, E.G.; Ackermann, R.J.,
First ionization potentials of some refractory oxide vapors,
J. Chem. Phys., 1974, 60, 1396. [all data]
Blackburn and Danielson, 1972
Blackburn, P.E.; Danielson, P.M.,
Electron impact relative ionization cross sections fragmentation of U, UO, UO2, and UO3,
J. Chem. Phys., 1972, 56, 6156. [all data]
Pattoret, Drowart, et al., 1968
Pattoret, A.; Drowart, J.; Smoes, S.,
Etudes thermodynamiques par spectrometrie de masse sur le systeme uranium-oxygene
in Thermodyn. Nucl. Mater. Proc. Symp., 1967 Vienna, 1968, 613. [all data]
Mann, 1964
Mann, J.B.,
Ionization of U, UO, and UO2 by electron impact,
J. Chem. Phys., 1964, 40, 1632. [all data]
DeMaria, Burns, et al., 1960
DeMaria, G.; Burns, R.P.; Drowart, J.; Inghram, M.G.,
Mass spectrometric study of gaseous molybdenum, tungsten, and uranium oxides,
J. Chem. Phys., 1960, 32, 1373. [all data]
Han, Goncharov, et al., 2004
Han, J.; Goncharov, V.; Kaledin, L.A.; Komissarov, A.V.; Heaven, M.C.,
Electronic spectroscopy and ionization potential of UO[sub 2] in the gas phase,
J. Chem. Phys., 2004, 120, 11, 5155, https://doi.org/10.1063/1.1647531
. [all data]
Lue, Jin, et al., 2004
Lue, C.J.; Jin, J.; Ortiz, M.J.; Rienstra-Kiracofe, J.C.; Heaven, M.C.,
Electronic Spectroscopy of UO,
J. Am. Chem. Soc., 2004, 126, 6, 1812, https://doi.org/10.1021/ja038940h
. [all data]
Gabelnick, Reedy, et al., 1973
Gabelnick, S.D.; Reedy, G.T.; Chasanov, M.G.,
Infrared spectra of matrix-isolated uranium oxide species. I. The stretching region,
J. Chem. Phys., 1973, 58, 10, 4468, https://doi.org/10.1063/1.1679009
. [all data]
Green, Reedy, et al., 1980
Green, D.W.; Reedy, G.T.; Gabelnick, S.D.,
Infrared spectra of matrix-isolated uranium oxides. III. Low-frequency modes,
J. Chem. Phys., 1980, 73, 9, 4207, https://doi.org/10.1063/1.440704
. [all data]
Sankaran, Sundararajan, et al., 1999
Sankaran, K.; Sundararajan, K.; Viswanathan, K.S.,
A matrix isolation FTIR investigation of laser-ablated uranium oxide in argon and nitrogen matrices,
Bull. Mater. Sci., 1999, 22, 4, 785, https://doi.org/10.1007/BF02745606
. [all data]
Hunt and Andrews, 1993
Hunt, R.D.; Andrews, L.,
Reactions of pulsed-laser evaporated uranium atoms with molecular oxygen: Infrared spectra of UO, UO2, UO3, UO2+, UO22+, and UO3--O2 in solid argon,
J. Chem. Phys., 1993, 98, 5, 3690, https://doi.org/10.1063/1.464045
. [all data]
Zhou, Andrews, et al., 2000
Zhou, M.; Andrews, L.; Ismail, N.; Marsden, C.,
Infrared Spectra of UO,
J. Phys. Chem. A, 2000, 104, 23, 5495, https://doi.org/10.1021/jp000292q
. [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, Condensed phase thermochemistry data, Gas phase ion energetics data, Vibrational and/or electronic energy levels, References
- Symbols used in this document:
S°solid,1 bar Entropy of solid at standard conditions (1 bar) ΔfH°solid Enthalpy of formation of solid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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