Methane, fluorotrinitro-
- Formula: CFN3O6
- Molecular weight: 169.0256
- IUPAC Standard InChIKey: IHOVZLJULZIGOW-UHFFFAOYSA-N
- CAS Registry Number: 1840-42-2
- 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. - Other names: Fluorotrinitromethane
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Condensed phase thermochemistry data
Go To: Top, Phase change data, Mass spectrum (electron ionization), 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°liquid | -52.64 ± 0.48 | kcal/mol | Ccr | Zimmer, Robb, et al., 1966 | Corrected for CODATA value of ΔfH; hcomb of the compound with Ethyl oxalate |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°liquid | -797.47 ± 0.48 | kcal/mol | Ccr | Zimmer, Robb, et al., 1966 | Corrected for CODATA value of ΔfH; hcomb of the compound with Ethyl oxalate |
Phase change data
Go To: Top, Condensed phase thermochemistry data, Mass spectrum (electron ionization), 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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tfus | 244.15 | K | N/A | Zimmer, Robb, et al., 1966, 2 | Uncertainty assigned by TRC = 0.1 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 8.30 ± 0.10 | kcal/mol | V | Zimmer, Robb, et al., 1966 | Corrected for CODATA value of ΔfH; Reanalyzed by Cox and Pilcher, 1970, Original value = 8.171 kcal/mol; hcomb of the compound with Ethyl oxalate; ALS |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
8.17 | 289. | A,T | Stephenson and Malanowski, 1987 | Based on data from 274. to 358. K. See also Zimmer, Robb, et al., 1966.; AC |
Mass spectrum (electron ionization)
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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
NIST MS number | 6596 |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Zimmer, Robb, et al., 1966
Zimmer, M.F.; Robb, R.A.; Baroody, E.E.; Carpenter, G.A.,
Heat of formation and other properties of trinitrofluoromethane,
J. Chem. Eng. Data, 1966, 11, 577-579. [all data]
Zimmer, Robb, et al., 1966, 2
Zimmer, M.F.; Robb, R.A.; Baroody, E.E.; Carpenter, G.A.,
Heat of Formation and Other Properties of Trinitrofluoromethane,
J. Chem. Eng. Data, 1966, 11, 577. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [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, Condensed phase thermochemistry data, Phase change data, Mass spectrum (electron ionization), References
- Symbols used in this document:
Tfus Fusion (melting) point ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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