5-Amino-6-Nitro-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C4H4N4O4
IUPAC Name 5-amino-6-nitro-1h-pyrimidine-2,4-dione
Molecular Mass 172.099 g·mol−1
Heat of Formation -305.8 ± 16.7 kJ·mol−1
Dipole Moment 3.19 ± 1.08 D
Volume 163.79 Å 3
Surface Area 168.08 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 1.13 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-amino 6-nitro uracil
  • 5-amino-6-nitropyrimidine-2,4(1h,3h)-dione
  • unc
InChIKey CLOSWQFGCBFNCK-UHFFFAOYSA-N
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