2,6-Diamino-8-Purinol

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Properties Simple | Detailed

Formula C5H6N6O
IUPAC Name 2,6-diamino-7,9-dihydropurin-8-one
Molecular Mass 166.141 g·mol−1
Heat of Formation 28.6 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 171.68 Å 3
Surface Area 177.82 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-diamino-1,7-dihydro-8h-purin-8-one
  • 2,6-diamino-7,9-dihydropurin-8-one
  • oprea1_139337
CAS Number(s)
  • 123333-49-3
  • 72308-52-2
InChIKey LREVGBUCKQNOFO-UHFFFAOYSA-N
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