Diphenyl sulfide

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Gas 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
Δfgas55.3 ± 0.7kcal/molCcbMackle and Mayrick, 1962 

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
Δfliquid39.14 ± 0.47kcal/molCcbMackle and Mayrick, 1962ALS
Quantity Value Units Method Reference Comment
Δcliquid-1653.19 ± 0.47kcal/molCcbMackle and Mayrick, 1962ALS

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
64.79298.5Smith and Andrews, 1931T = 102 to 298 K. Value is unsmoothed experimental datum.; 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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Tboil569.2KN/AWeast and Grasselli, 1989BS
Tboil569.65KN/APerkin, 1896Uncertainty assigned by TRC = 0.5 K; TRC
Quantity Value Units Method Reference Comment
Tfus399.4KN/AHauptmann and Wladislaw, 1950Uncertainty assigned by TRC = 8. K; TRC
Tfus409.KN/AHauptmann and Wladislaw, 1950Uncertainty assigned by TRC = 4. K; TRC
Tfus438.KN/AHauptmann and Wladislaw, 1950Uncertainty assigned by TRC = 10. K; TRC
Tfus247.25KN/ASmith and Andrews, 1931, 2Uncertainty assigned by TRC = 0.5 K; TRC
Quantity Value Units Method Reference Comment
Δvap16.2 ± 0.5kcal/molCMackle and Mayrick, 1962ALS
Δvap16.3kcal/molN/AMackle and Mayrick, 1962DRB

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
14.5384.N/ADykyj, Svoboda, et al., 1999Based on data from 369. to 566. K.; AC
16.1 ± 0.07360.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
15.4 ± 0.07400.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
14.7 ± 0.07440.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
13.9 ± 0.07480.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
13.2 ± 0.07520.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
12.4 ± 0.07560.EB,IPSteele, Chirico, et al., 1995Based on data from 345. to 611. K.; AC
13.9384.AStephenson and Malanowski, 1987Based on data from 369. to 566. K. See also Kretschmer and Wiebe, 1949.; 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
369.3 to 565.74.800402519.224-41.188Stull, 1947Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Method Reference Comment
3.341258.ACSteele, Chirico, et al., 1995Based on data from 5. to 440. K.; AC

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

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Mackle and Mayrick, 1962
Mackle, H.; Mayrick, R.G., Studies in thermochemistry of organic sulphides. Part 3.-The gas-phase heats of formation of diphenyl sulphide, dibenzyl sulphide, diphenyl disulphide,4-thia-1-hexene and 4-thia-5,5-dimethyl-1-hexene, Trans. Faraday Soc., 1962, 58, 238-243. [all data]

Smith and Andrews, 1931
Smith, R.H.; Andrews, D.H., Thermal energy studies. II. Phenyl derivatives of metals, J. Am. Chem. Soc., 1931, 53, 3661-3667. [all data]

Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]

Perkin, 1896
Perkin, W.H., LXIX. On Magnetic Rotatory Power, especially of Aromatic Compounds, J. Chem. Soc., 1896, 69, 1025-1257. [all data]

Hauptmann and Wladislaw, 1950
Hauptmann, H.; Wladislaw, B., The Action of Raney Nickel on SUlfur Compounds III. Aromatic Thioesters, J. Am. Chem. Soc., 1950, 72, 710. [all data]

Smith and Andrews, 1931, 2
Smith, R.H.; Andrews, D.H., Thermal Energy Studies II. Phenyl Derivatives of Metals, J. Am. Chem. Soc., 1931, 53, 3661-7. [all data]

Dykyj, Svoboda, et al., 1999
Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.L.; Hall, K.R., Vapor Pressure of Chemicals: Part A. Vapor Pressure and Antoine Constants for Hydrocarbons and Sulfur, Selenium, Tellurium and Hydrogen Containing Organic Compounds, Springer, Berlin, 1999, 373. [all data]

Steele, Chirico, et al., 1995
Steele, W.V.; Chirico, R.D.; Cowell, A.B.; Nguyen, A.; Knipmeyer, S.E., Possible precursors and products of deep hydrodesulfurization of distillate fuels, The Journal of Chemical Thermodynamics, 1995, 27, 12, 1407-1428, https://doi.org/10.1006/jcht.1995.0149 . [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]

Kretschmer and Wiebe, 1949
Kretschmer, Carl B.; Wiebe, Richard., Liquid-Vapor Equilibrium of Ethanol--Toluene Solutions, J. Am. Chem. Soc., 1949, 71, 5, 1793-1797, https://doi.org/10.1021/ja01173a076 . [all data]

Stull, 1947
Stull, Daniel R., Vapor Pressure of Pure Substances. Organic and Inorganic Compounds, Ind. Eng. Chem., 1947, 39, 4, 517-540, https://doi.org/10.1021/ie50448a022 . [all data]


Notes

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