3H-1,2-Dithiole-3-thione, 5-phenyl-

• Formula: C₉H₆S₃
• Molecular weight: 210.339
• IUPAC Standard InChI: InChI=1S/C9H6S3/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h1-6H Copy

  
• IUPAC Standard InChIKey: NYJHOCZVKHRRLG-UHFFFAOYSA-N Copy
• CAS Registry Number: 3445-76-9
• Chemical structure:
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• Information on this page:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • References
  • Notes
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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

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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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:
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.

Enthalpy of sublimation

Enthalpy of fusion

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 compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

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

References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics 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.

Geiseler and Rauh, 1972
Geiseler, G.; Rauh, H.-J., Bildungsenthalpien und Mesomerieenergien von π-Bindungssystemen 3. Mitteilung: Bildungsenthalpie und Verdrillung der S-S-Bindung in Trithionen, Z. Phys. Chem. (Leipzig), 1972, 249, 376-382. [all data]

Geiseler and Rauh, 1972, 2
Geiseler, G.; Rauh, H.J., Z. Phys. Chem. (Leipzig), 1972, 249, 376. [all data]

Dollo, Corre, et al., 1999
Dollo, Gilles; Corre, Pascal Le; Chollet, Marylene; Chevanne, Fran«65533»ois; Bertault, Marcel; Burgot, Jean-Louis; Verge, Roger Le, Improvement in solubility and dissolution rate of 1,2-dithiole-3-thiones upon complexation with?-cyclodextrin and its hydroxypropyl and sulfobutyl ether-7 derivatives, J. Pharm. Sci., 1999, 88, 9, 889-895, https://doi.org/10.1021/js990067o . [all data]

Gonbeau, Guimon, et al., 1975
Gonbeau, D.; Guimon, C.; Deschamps, J.; Pfister-Guillouzo, G., Electronic structure of sulphur compounds IX. Photoelectron spectra of various 1,2-dithiole-3-thiones, J. Electron Spectrosc. Relat. Phenom., 1975, 6, 99. [all data]

Notes

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• Symbols used in this document:
  

  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
  ΔsubH	Enthalpy of sublimation
  ΔsubH°	Enthalpy of sublimation at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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