Ethanethioamide
- Formula: C2H5NS
- Molecular weight: 75.133
- IUPAC Standard InChIKey: YUKQRDCYNOVPGJ-UHFFFAOYSA-N
- CAS Registry Number: 62-55-5
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Acetamide, thio-; Acetimidic acid, thio-; Acetothioamide; Thiacetamide; Thioacetamide; TAA; CH3CSNH2; USAF CB-21; USAF EK-1719; Rcra waste number U218; NSC 2120
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | 12.7 ± 1.2 | kJ/mol | Ccr | Inagaki, Murata, et al., 1982 | |
ΔfH°gas | 9.8 ± 0.5 | kJ/mol | Ccr | Sabbah and Gomez, 1982 |
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 as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°solid | -70.6 ± 1.1 | kJ/mol | Ccr | Inagaki, Murata, et al., 1982 | ALS |
ΔfH°solid | -73.01 ± 0.43 | kJ/mol | Ccr | Sabbah and Gomez, 1982 | ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -2033.4 ± 1.1 | kJ/mol | Ccr | Inagaki, Murata, et al., 1982 | ALS |
ΔcH°solid | -2030.56 ± 0.36 | kJ/mol | Ccr | Sabbah and Gomez, 1982 | ALS |
Constant pressure heat capacity of solid
Cp,solid (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
100.3 | 298. | Sabbah and Torres-Gomez, 1982 | Cp given as 1.335 J/g*K.; DH |
Phase change 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 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
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tfus | 386.42 | K | N/A | Donnelly, Drewes, et al., 1990 | Uncertainty assigned by TRC = 0.2 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 83.26 ± 0.34 | kJ/mol | C | Inagaki, Murata, et al., 1982 | ALS |
ΔsubH° | 83.3 ± 0.3 | kJ/mol | C | Inagaki, Murata, et al., 1982 | See also Murata, Sakiyama, et al., 1985.; AC |
ΔsubH° | 82.80 ± 0.25 | kJ/mol | V | Sabbah and Gomez, 1982 | ALS |
ΔsubH° | 82.8 ± 0.3 | kJ/mol | C | Sabbah and Gomez, 1982 | AC |
Enthalpy of sublimation
ΔsubH (kJ/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
82.800 | 298.15 | Sabbah and Torres-Gomez, 1982 | DH |
Entropy of sublimation
ΔsubS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
277.7 | 298.15 | Sabbah and Torres-Gomez, 1982 | DH |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
18.36 | 385.7 | Donnelly, Drewes, et al., 1990, 2 | AC |
Reaction 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: John E. Bartmess
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
C2H4NS- + =
By formula: C2H4NS- + H+ = C2H5NS
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1449. ± 8.8 | kJ/mol | G+TS | Decouzon, Exner, et al., 1994 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 1420. ± 8.4 | kJ/mol | IMRE | Decouzon, Exner, et al., 1994 | gas phase |
Mass spectrum (electron ionization)
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Due to licensing restrictions, this spectrum cannot be downloaded.
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. |
---|---|
Origin | Japan AIST/NIMC Database- Spectrum MS-NW-4995 |
NIST MS number | 230089 |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry 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.
Inagaki, Murata, et al., 1982
Inagaki, S.; Murata, S.; Sakiyama, M.,
Thermochemical studies on thioacetamide and tetramethylthiourea. Estimation of stablization energies due to interaction between thiocarbonyl group and neighboring nitrogen atom,
Bull. Chem. Soc. Jpn., 1982, 55, 2808-2813. [all data]
Sabbah and Gomez, 1982
Sabbah, R.; Gomez, L.A.T.,
Thermodynamique de substances soufrees. III. Etude thermochimique de la thioacetamide et de la thiobenzamide,
Thermochim. Acta, 1982, 52, 285-295. [all data]
Sabbah and Torres-Gomez, 1982
Sabbah, R.; Torres-Gomez, L.A.,
Thermodynamics of sulfur-containing compounds. III. Thermochemical study of thioacetamide and thiobenzamide,
Thermochim. Acta, 1982, 52, 285-295. [all data]
Donnelly, Drewes, et al., 1990
Donnelly, J.R.; Drewes, L.A.; Johnson, R.L.; Munslow, W.D.; Knapp, K.K.; Sovocool, G.W.,
Purity and heat of fusion data for environmental standards as determined by differential scanning calorimetry,
Thermochim. Acta, 1990, 167, 2, 155, https://doi.org/10.1016/0040-6031(90)80476-F
. [all data]
Murata, Sakiyama, et al., 1985
Murata, S.; Sakiyama, M.; Seki, S.,
Sublimation calorimetric studies using a calvet microcalorimeter,
Thermochimica Acta, 1985, 88, 1, 121-126, https://doi.org/10.1016/0040-6031(85)85419-8
. [all data]
Donnelly, Drewes, et al., 1990, 2
Donnelly, J.R.; Drewes, L.A.; Johnson, R.L.; Munslow, W.D.; Knapp, K.K.; Sovocool, G.W.,
Purity and heat of fusion data for environmental standards as determined by differential scanning calorimetry,
Thermochimica Acta, 1990, 167, 2, 155-187, https://doi.org/10.1016/0040-6031(90)80476-F
. [all data]
Decouzon, Exner, et al., 1994
Decouzon, M.; Exner, O.; Gal, J.F.; Maria, P.C.; Waisser, K.,
Acidity and basicity of thiocarboxamides in the gas phase,
J. Phys. Org. Chem., 1994, 7, 9, 511, https://doi.org/10.1002/poc.610070907
. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid Tfus Fusion (melting) point 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 ΔfusH Enthalpy of fusion ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions ΔsubH Enthalpy of sublimation ΔsubH° Enthalpy of sublimation at standard conditions ΔsubS Entropy of sublimation - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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