2,4-Dithiouracil

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Properties Simple | Detailed

Formula C4H4N2S2
IUPAC Name pyrimidine-2,4-dithione
Molecular Mass 144.218 g·mol−1
Heat of Formation 212.1 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 157.26 Å 3
Surface Area 161.36 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 1.30 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-pyrimidine-2,4-dithione
  • 2,4(1h,3h)-pyrimidinedithione
  • 2,4-dimercaptopyrimidine
  • 2,4-dithiopyrimidine
  • 2,4-dithioxopyrimidine
  • 2,4-pyrimidinedithiol
  • dithiopyrimidine
  • dithiouracil
  • pyrimidine-2,4(1h,3h)-dithione
  • uracil, 2,4-dithio-
  • usaf cb-14
CAS Number(s)
  • 1193-28-8
  • 2001-93-6
  • 35455-73-3
InChIKey ZEQIWKHCJWRNTH-UHFFFAOYSA-N
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