Tetrachloroethylene

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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 as indicated in comments:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfgas-2.971kcal/molReviewChase, 1998Data last reviewed in September, 1967
Δfgas-5.8 ± 1.kcal/molReviewManion, 2002weighted average of several measurements of equilibria involving C2Cl6,CCl4, C2Cl4, C2HCl5, and C2HCl3; DRB
Δfgas-3.6kcal/molCmKirkbride, 1956ALS
Quantity Value Units Method Reference Comment
gas,1 bar82.079cal/mol*KReviewChase, 1998Data last reviewed in September, 1967

Gas Phase Heat Capacity (Shomate Equation)

Cp° = A + B*t + C*t2 + D*t3 + E/t2
H° − H°298.15= A*t + B*t2/2 + C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 − E/(2*t2) + G
    Cp = heat capacity (cal/mol*K)
    H° = standard enthalpy (kcal/mol)
    S° = standard entropy (cal/mol*K)
    t = temperature (K) / 1000.

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Temperature (K) 298. to 1100.1100. to 6000.
A 17.3906031.46011
B 31.298900.197311
C -26.75189-0.043012
D 8.2929400.003294
E -0.154032-1.550141
F -9.843201-16.58770
G 94.04121113.8540
H -2.969891-2.969891
ReferenceChase, 1998Chase, 1998
Comment Data last reviewed in September, 1967 Data last reviewed in September, 1967

Condensed phase thermochemistry data

Go To: Top, Gas 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 as indicated in comments:
DRB - Donald R. Burgess, Jr.
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
Δfliquid-15.3 ± 1.kcal/molReviewManion, 2002derived from recommended ΔfHgas° and ΔvapH°; DRB
Δfliquid-13.0kcal/molCmKirkbride, 1956ALS
Quantity Value Units Method Reference Comment
Δcliquid-199. ± 3.kcal/molCcbSmith, Bjellerup, et al., 1953ALS
Quantity Value Units Method Reference Comment
liquid57.50cal/mol*KN/ANovoselova, Rabinovich, et al., 1986DH

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
35.172298.15Wilhelm, Lainez, et al., 1989DH
37.74298.15Novoselova, Rabinovich, et al., 1986T = 6 to 300 K.; DH
35.01298.15Grolier, Inglese, et al., 1982T = 298.15 K. One data point given.; DH
33.39298.Kurbatov, 1948T = 16 to 119°C, mean Cp two temperatures.; DH
35.11298.von Reis, 1881T = 291 to 410 K.; DH

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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
BS - Robert L. Brown and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
CAL - James S. Chickos, William E. Acree, Jr., Joel F. Liebman, Students of Chem 202 (Introduction to the Literature of Chemistry), University of Missouri -- St. Louis

Quantity Value Units Method Reference Comment
Tboil394.2 ± 0.4KAVGN/AAverage of 14 out of 15 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus250.97KN/ADreisbach and Martin, 1949Uncertainty assigned by TRC = 0.05 K; TRC
Tfus250.6KN/AVan de Vloed, 1939Uncertainty assigned by TRC = 0.6 K; TRC
Quantity Value Units Method Reference Comment
Ttriple250.81KN/ANovoselova, Rabinovich, et al., 1986, 2Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC
Quantity Value Units Method Reference Comment
Tc620.KN/AMajer and Svoboda, 1985 
Quantity Value Units Method Reference Comment
Δvap9.493kcal/molN/AMajer and Svoboda, 1985 
Δvap9.49 ± 0.01kcal/molReviewManion, 2002weighted average of several measurements plus a correction for non-ideality; DRB
Δvap9.49 ± 0.02kcal/molCMajer, Sváb, et al., 1980AC
Δvap9.50 ± 0.20kcal/molVMathews, 1926Reanalyzed by Pedley, Naylor, et al., 1986, Original value = 8.30 ± 0.03 kcal/mol; ALS

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
8.289394.1N/AMajer and Svoboda, 1985 
9.18322.N/ADejoz, Cruz Burguet, et al., 1995Based on data from 307. to 393. K.; AC
9.25325.AStephenson and Malanowski, 1987Based on data from 310. to 393. K. See also Boublík and Aim, 1972.; AC
9.30315.N/APolak, Murakami, et al., 1970Based on data from 300. to 380. K. See also Boublik, Fried, et al., 1984.; AC
8.99348.N/AFried, Gallant, et al., 1967Based on data from 333. to 373. K.; AC

Antoine Equation Parameters

log10(P) = A − (B / (T + C))
    P = vapor pressure (atm)
    T = temperature (K)

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Temperature (K) A B C Reference Comment
301.03 to 380.844.174851440.819-49.171Polak, Murakami, et al., 1970Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
2.6004250.81Novoselova, Rabinovich, et al., 1986DH
2.600250.8Domalski and Hearing, 1996AC

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
10.37250.81Novoselova, Rabinovich, et al., 1986DH

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
0.93210.Domalski and Hearing, 1996CAL
10.37250.8

Enthalpy of phase transition

ΔHtrs (kcal/mol) Temperature (K) Initial Phase Final Phase Reference Comment
0.196125. to 210.crystaline, IIcrystaline, INovoselova, Rabinovich, et al., 1986DH

Entropy of phase transition

ΔStrs (cal/mol*K) Temperature (K) Initial Phase Final Phase Reference Comment
1.26125. to 210.crystaline, IIcrystaline, INovoselova, Rabinovich, et al., 1986DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


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.

Chase, 1998
Chase, M.W., Jr., NIST-JANAF Themochemical Tables, Fourth Edition, J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]

Manion, 2002
Manion, J.A., Evaluated Enthalpies of Formation of the Stable Closed Shell C1 and C2 Chlorinated Hydrocarbons, J. Phys. Chem. Ref. Data, 2002, 31, 1, 123-172, https://doi.org/10.1063/1.1420703 . [all data]

Kirkbride, 1956
Kirkbride, F.W., The heats of chlorination of some hydrocarbons and their chloro-derivatives, J. Appl. Chem., 1956, 6, 11-21. [all data]

Smith, Bjellerup, et al., 1953
Smith, L.; Bjellerup, L.; Krook, S.; Westermark, H., Heats of combustion of organic chloro compounds determined by the "quartz wool" method, Acta Chem. Scand., 1953, 7, 65. [all data]

Novoselova, Rabinovich, et al., 1986
Novoselova, N.V.; Rabinovich, I.B.; Tsvetkova, L.Ya.; Moseeva, E.M.; Babinkov, A.G., Heat capacity and thermodynamic functions of tetrachloroethylene, Zhur. Fiz. Khim., 1986, 60, 1627-1630. [all data]

Wilhelm, Lainez, et al., 1989
Wilhelm, E.; Lainez, A.; Grolier, J.-P.E., Thermodynamics of (a halogenated ethane or ethene + an n-alkane). VE and CpE of mixtures containing either 1,1,2,2-tetrachloroethane or tetrachloroethene, Fluid Phase Equilib., 1989, 49, 233-250. [all data]

Grolier, Inglese, et al., 1982
Grolier, J.-P.E.; Inglese, A.; Wilhelm, E., Excess volumes and excess heat capacities of tetrachloroethene + cyclohexane, + methylcyclohexane, + benzene, and + toluene at 298.15 K, J. Chem. Thermodynam., 1982, 14, 523-529. [all data]

Kurbatov, 1948
Kurbatov, V.Ya., Heat capacity of liquids. 2. Heat capacity and the temperature dependence of heat capacity from halogen derivatives of acylic hydrocarbons, Zh. Obshch. Kim., 1948, 18, 372-389. [all data]

von Reis, 1881
von Reis, M.A., Die specifische Wärme flüssiger organischer Verbindungen und ihre Beziehung zu deren Moleculargewicht, Ann. Physik [3], 1881, 13, 447-464. [all data]

Dreisbach and Martin, 1949
Dreisbach, R.R.; Martin, R.A., Physical Data on Some Organic Compounds, Ind. Eng. Chem., 1949, 41, 2875-8. [all data]

Van de Vloed, 1939
Van de Vloed, A., Bull. Soc. Chim. Belg., 1939, 48, 229. [all data]

Novoselova, Rabinovich, et al., 1986, 2
Novoselova, N.V.; Rabinovich, I.B.; Tsvetkova, L.Ya.; Moseeva, E.M.; Babinkov, A.G., Heat capacity and thermodynamic functions of tetrachloroethylene, Zh. Fiz. Khim., 1986, 60, 1627-30. [all data]

Majer and Svoboda, 1985
Majer, V.; Svoboda, V., Enthalpies of Vaporization of Organic Compounds: A Critical Review and Data Compilation, Blackwell Scientific Publications, Oxford, 1985, 300. [all data]

Majer, Sváb, et al., 1980
Majer, V.; Sváb, L.; Svoboda, V., Enthalpies of vaporization and cohesive energies for a group of chlorinated hydrocarbons, The Journal of Chemical Thermodynamics, 1980, 12, 9, 843-847, https://doi.org/10.1016/0021-9614(80)90028-2 . [all data]

Mathews, 1926
Mathews, J.H., The accurate measurement of heats of vaporization of liquids, J. Am. Chem. Soc., 1926, 48, 562-576. [all data]

Pedley, Naylor, et al., 1986
Pedley, J.B.; Naylor, R.D.; Kirby, S.P., Thermochemical Data of Organic Compounds, Chapman and Hall, New York, 1986, 1-792. [all data]

Dejoz, Cruz Burguet, et al., 1995
Dejoz, Ana; Cruz Burguet, M.; Munoz, Rosa; Sanchotello, Margarita, Isobaric Vapor-Liquid Equilibria of Tetrachloroethylene with 1-Butanol and 2-Butanol at 6 and 20 kPa, J. Chem. Eng. Data, 1995, 40, 1, 290-292, https://doi.org/10.1021/je00017a064 . [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]

Boublík and Aim, 1972
Boublík, T.; Aim, K., Heats of vaporization of simple non-spherical molecule compounds, Collect. Czech. Chem. Commun., 1972, 37, 11, 3513-3521, https://doi.org/10.1135/cccc19723513 . [all data]

Polak, Murakami, et al., 1970
Polak, Jiri; Murakami, Sachio; Lam, V.T.; Benson, George C., Excess enthalpy, volume, and Gibbs free energy of cyclopentane-tetrachloroethylene mixtures at 25.deg., J. Chem. Eng. Data, 1970, 15, 2, 323-328, https://doi.org/10.1021/je60045a041 . [all data]

Boublik, Fried, et al., 1984
Boublik, T.; Fried, V.; Hala, E., The Vapour Pressures of Pure Substances: Selected Values of the Temperature Dependence of the Vapour Pressures of Some Pure Substances in the Normal and Low Pressure Region, 2nd ed., Elsevier, New York, 1984, 972. [all data]

Fried, Gallant, et al., 1967
Fried, Vojtech; Gallant, Paul; Schneier, Gary B., Vapor-liquid equilibrium in the system pyridine-tetrachloroethylene, J. Chem. Eng. Data, 1967, 12, 4, 504-508, https://doi.org/10.1021/je60035a011 . [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, References