Trithiocyanuric Acid

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Properties Simple | Detailed

Formula C3H3N3S3
IUPAC Name 1,3,5-triazinane-2,4,6-trithione
Molecular Mass 177.271 g·mol−1
Heat of Formation 246.5 ± 16.7 kJ·mol−1
Dipole Moment 0.00 ± 1.08 D
Volume 181.76 Å 3
Surface Area 182.2 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -2.33 ± eV
Point Group Symmetry D3h
Synonyms
  • 1,3,5-triazine-2,4,6(1h,3h,5h)-trithione
  • 1,3,5-triazine-2,4,6-trimercaptan
  • 1,3,5-triazine-2,4,6-trithiol
  • 1,3,5-trimercaptotriazine
  • 2,4,6-triazinetrithiol
  • 2,4,6-trimercapto-1,3,5-triazine
  • 2,4,6-trimercapto-s-triazine
  • cyanuric acid, trithio-
  • s-triazine-2,4,6(1h,3h,5h)-trithione
  • s-triazine-2,4,6-trithiol
  • thiocyanuric acid
  • trimercaptocyanuric acid
  • trismercaptotriazine
  • usaf th-3
CAS Number(s)
  • 2060-82-4
  • 638-16-4
InChIKey WZRRRFSJFQTGGB-UHFFFAOYSA-N
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