8-Amino-3,7-Dihydro-1H-Purine-2,6-Dione

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Formula C5H5N5O2
IUPAC Name 8-amino-3,7-dihydropurine-2,6-dione
Molecular Mass 167.125 g·mol−1
Heat of Formation -175.7 ± 16.7 kJ·mol−1
Dipole Moment 5.57 ± 1.08 D
Volume 169.82 Å 3
Surface Area 174.34 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 2.32 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-purine-2,6-dione, 8-amino-3,7-dihydro-
  • 8-amino-2,6-dihydroxypurine
  • 8-amino-3,7-dihydropurine-2,6-dione
  • 8-amino-7h-xanthine
  • 8-aminoxanthine
CAS Number(s)
  • 5461-03-0
InChIKey MWAMGTOITZRWMI-UHFFFAOYSA-N
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