2,6-Diamino-5-Nitrosopyrimidin-4-Ol

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Properties Simple | Detailed

Formula C4H5N5O2+
IUPAC Name 2,6-diamino-5-nitroso-pyrimidin-3-ium-5-ylium-4-one
Molecular Mass 155.115 g·mol−1
Heat of Formation -37.0 ± 16.7 kJ·mol−1
Dipole Moment 7.69 ± 1.08 D
Volume 159.73 Å 3
Surface Area 165.84 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,6-diamino-5-nitroso-4-pyrimidinol
  • 4(1h)-pyrimidinone, 2,6-diamino-5-nitroso-
  • 4(1h)-pyrimidinone, 2,6-diamino-5-nitroso- (9ci)
  • 4-pyrimidinol, 2,6-diamino-5-nitroso-
  • 4-pyrimidol, 2,6-diamino-5-nitroso
  • 4-pyrimidol, 2,6-diamino-5-nitroso-
CAS Number(s)
  • 62128-61-4
  • 2387-48-6
InChIKey HVMRLFSFHWCUCG-UHFFFAOYSA-N
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