Oxoguanine

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Properties Simple | Detailed

Formula C5H11N5O
IUPAC Name 6-amino-7,9-dihydro-2h-purine-1,2,3,4,5,6-hexaid-8-one
Molecular Mass 157.174 g·mol−1
Heat of Formation 42.8 ± 16.7 kJ·mol−1
Dipole Moment 3.74 ± 1.08 D
Volume 157.94 Å 3
Surface Area 164.02 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-purin-6-amine, 8-hydroxy-
  • 6-amino-7,9-dihydro-purin-8-one
  • 6-amino-7,9-dihydropurin-8-one
  • 6-amino-8-hydroxypurine
  • 6-amino-8-purinol
  • 7,8-dhoa
  • 7,8-dihydro-8-oxoadenine
  • 8-hydroxyadenine
  • 8-oxoadenine
  • 8h-purin-8-one, 6-amino-1,7-dihydro-
  • 8h-purin-8-one, 6-amino-1,7-dihydro- (9ci)
  • bas 01118250
  • oksaden
  • oprea1_197965
  • oprea1_428248
  • oxaden
  • oxyadenine
  • purin-8(9h)-one, 6-amino-
  • purin-8(9h)-one, 6-amino- (8ci)
CAS Number(s)
  • 21149-26-8
InChIKey RGKBRPAAQSHTED-UHFFFAOYSA-N
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