3,4-Toluenedithiol

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Properties Simple | Detailed

Formula C7H8S2
IUPAC Name 4-methylbenzene-1,2-dithiol
Molecular Mass 156.268 g·mol−1
Heat of Formation 60.4 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 184.81 Å 3
Surface Area 182.82 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenedithiol, 4-methyl-
  • 1,2-dimercapto-4-methylbenzene
  • 3,4-dimercaptotoluene
  • 3,4-dimercaptotoluol
  • 4-methyl-1,2-benzenedithiol
  • 4-methyl-1,2-dimercaptobenzene
  • dithiol
  • o-toluenesulfonylamide
  • toluene-3,4-dithiol
  • usaf b-59
CAS Number(s)
  • 496-74-2
InChIKey NIAAGQAEVGMHPM-UHFFFAOYSA-N
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