Thianthrene

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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
Δfsolid44.6 ± 1.1kcal/molCcbSabbah and El Watik, 1989ALS
Δfsolid44.03 ± 0.36kcal/molCcrJohnson, 1975ALS
Δfsolid43.64 ± 0.32kcal/molCcrSunner, 1963See Sunner, 1962; ALS
Δfsolid43.32 ± 0.56kcal/molCcrHubbard, Katz, et al., 1954Heat of combustion calculated author's U=-1730.01; ALS
Quantity Value Units Method Reference Comment
Δcsolid-1733. ± 3.kcal/molAVGN/AAverage of 7 values; Individual data points
Quantity Value Units Method Reference Comment
solid,1 bar55.184cal/mol*KN/ASteele, Chirico, et al., 1993DH

Constant pressure heat capacity of solid

Cp,solid (cal/mol*K) Temperature (K) Reference Comment
52.622298.15Steele, Chirico, et al., 1993T = 5 to 700 K.; DH
53.769298.15Sabbah and Watik, 1989DH

Gas phase ion energetics 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 evaluated as indicated in comments:
L - Sharon G. Lias

Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Quantity Value Units Method Reference Comment
IE (evaluated)7.8eVN/AN/AL

Ionization energy determinations

IE (eV) Method Reference Comment
7.7PETraven', Redchenko, et al., 1981LLK
7.80 ± 0.03EINounou, 1966RDSH
7.9CTSKuboyama, 1964RDSH
7.93PETraven', Redchenko, et al., 1981Vertical value; LLK

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.

Sabbah and El Watik, 1989
Sabbah, R.; El Watik, L., Etude thermodynamique de la molecule de thianthrene, Thermochim. Acta, 1989, 138, 241-247. [all data]

Johnson, 1975
Johnson, W.H., The enthalpies of combustion and formation of thianthrene, J. Res. NBS, 1975, 79, 561-564. [all data]

Sunner, 1963
Sunner, S., Corrected heat of combustion and formation values for a number of organic sulphur compounds, Acta Chem. Scand., 1963, 17, 728-730. [all data]

Sunner, 1962
Sunner, S., Corrected heat of combustion and formation values for a number of organic sulphur compounds, Private communication, 1962, 1-4. [all data]

Hubbard, Katz, et al., 1954
Hubbard, W.N.; Katz, C.; Waddington, G., A rotating combustion bomb for precision calorimetry. Heats of combustion of some sulfur-containing compounds, J. Phys. Chem., 1954, 58, 142. [all data]

Steele, Chirico, et al., 1993
Steele, W.V.; Chirico, R.D.; Knipmeyer, S.E.; Nguyen, A., The thermodynamic properties of thianthrene and phenoxathiin, J. Chem. Thermodyn., 1993, 25, 965-992. [all data]

Sabbah and Watik, 1989
Sabbah, R.; Watik, L.E., Etude thermodynamique de la molecule de thanthrene, Thermochim. Acta, 1989, 138, 241-247. [all data]

Traven', Redchenko, et al., 1981
Traven', V.F.; Redchenko, V.V.; Eismont, M.Y.; Stepanov, B.I., Photoelectron spectra and electronic and steric structures of silicon and sulfur-containing analogs of 9,10-dihydroanthracene, J. Gen. Chem. USSR, 1981, 51, 1099, In original 1297. [all data]

Nounou, 1966
Nounou, P., Etude des composes aromatiques par spectrometrie de masse. I. Mesure des potentials d'ionisation et d'apparition par la methode du potential retardateur et interpretation des courbes d'ionisation differentielle, J. Chim. Phys., 1966, 63, 994. [all data]

Kuboyama, 1964
Kuboyama, A., Molecular complexes and their spectra. XVII.The iodine and the chloranil complexes with thianthrene analogs, J. Am. Chem. Soc., 1964, 86, 164. [all data]


Notes

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