5-Nitrosopyrimidin-2,4,6-Triamin

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Properties Simple | Detailed

Formula C4H6N6O
IUPAC Name 5-nitrosopyrimidine-2,4,6-triamine
Molecular Mass 154.130 g·mol−1
Heat of Formation 139.4 ± 16.7 kJ·mol−1
Dipole Moment 2.58 ± 1.08 D
Volume 161.69 Å 3
Surface Area 168.43 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry Cs
Synonyms
  • (2,6-diamino-5-nitroso-pyrimidin-4-yl)amine
  • 2,4,6-pyrimidinetriamine, 5-nitroso-
  • 2,4,6-triamino-5-nitrosopyrimidine
  • 5-nitro-2,4,6-triaminopyrimidine
  • 5-nitroso-2,4,6-triaminopyrimidine
  • pyrimidine, 2,4,6-triamino-5-nitroso-
CAS Number(s)
  • 1006-23-1
InChIKey XLQQJSWJHHKLOK-UHFFFAOYSA-N
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