Bis(2,2,2-trinitroethyl)-amine
- Formula: C4H5N7O12
- Molecular weight: 343.1222
- IUPAC Standard InChI: InChI=1S/C4H5N7O12/c12-6(13)3(7(14)15,8(16)17)1-5-2-4(9(18)19,10(20)21)11(22)23/h5H,1-2H2
- IUPAC Standard InChIKey: HCQOJHQSPRZMIO-UHFFFAOYSA-N
- CAS Registry Number: 34880-53-0
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Phase change 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°gas | 11.3 ± 1.0 | kcal/mol | Ccb | Pepekin, Gafurov, et al., 1973 |
Condensed phase thermochemistry data
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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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°solid | -8.0 | kcal/mol | Ccb | Pepekin, Gafurov, et al., 1973 | |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔcH°solid | -539.0 ± 0.9 | kcal/mol | Ccb | Pepekin, Gafurov, et al., 1973 |
Phase change data
Go To: Top, Gas phase thermochemistry data, Condensed phase 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 as indicated in comments:
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Enthalpy of sublimation
| ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
|---|---|---|---|---|
| 19.3 ± 0.1 | 338. to 349. | ME,A | de Kruif and Oonk, 1973 | See also Pedley and Rylance, 1977 and Stephenson and Malanowski, 1987.; AC |
| 19.3 ± 0.1 | 338. | V | Pepekin, Gafurov, et al., 1973 | ALS |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Pepekin, Gafurov, et al., 1973
Pepekin, V.I.; Gafurov, R.G.; Lebedev, Yu.A.; Eremenko, L.T.; Sogomonyan, E.M.; Apin, A.Ya.,
Thermochemistry of N-Nitrosoamines,
Bull. Acad. Sci. USSR, Div. Chem. Sci., 1973, 304-307. [all data]
de Kruif and Oonk, 1973
de Kruif, C.G.; Oonk, H.A.J.,
The determination of enthalpies of sublimation by means of thermal conductivity manometers,
Chemie Ing. Techn., 1973, 45, 7, 455-461, https://doi.org/10.1002/cite.330450705
. [all data]
Pedley and Rylance, 1977
Pedley, J.B.; Rylance, J.,
, Computer Analysed Thermochemical Data: Organic and Organometallic Compounds, University of Sussex, Brighton, 1977. [all data]
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, References
- Symbols used in this document:
ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔsubH Enthalpy of sublimation - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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