1,3,5-Triazine-2,4(1H,3H)-Dione

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Properties Simple | Detailed

Formula C3H3N3O2++
IUPAC Name 1h-1,3,5-triazine-2,4-dione
Molecular Mass 113.075 g·mol−1
Heat of Formation -273.6 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 115.12 Å 3
Surface Area 127.41 Å 2
HOMO Energy -11.10 ± 0.55 eV
LUMO Energy 1.99 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3,5-triazine-2,4(3h,5h)-dione
  • 1h-s-triazine-2,4-quinone
  • 5-azauracil
  • ab-323/25048532
  • allantoxaidin
  • allantoxaidine
  • oxaidin
  • s-triazine-2,4(1h,3h)-dione
  • s-triazine-2,4(1h,3h)-dione (8ci)
CAS Number(s)
  • 71-33-0
InChIKey GEWRKGDRYZIFNP-UHFFFAOYSA-N
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