7,7'-(1,2-Ethanediyl)Bis(2-Amino-3,7-Dihydro-6H-Purin-6-One)

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Formula C12H26N10O2++
IUPAC Name 2-amino-7-[2-(2-amino-6-oxo-3,8-dihydropurine-1,2,4,5,8,9-hexaid-7-yl)ethyl]-3,8-dihydropurine-1,2,4,5,8,9-hexaid-6-one
Molecular Mass 342.401 g·mol−1
Heat of Formation 191.9 ± 16.7 kJ·mol−1
Dipole Moment 1.51 ± 1.08 D
Volume 349.5 Å 3
Surface Area 312.41 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-diguanylethane
  • 2-amino-7-[2-(2-amino-6-keto-3h-purin-7-yl)ethyl]-3h-purin-6-one
  • 2-amino-7-[2-(2-amino-6-oxo-3h-purin-7-yl)ethyl]-3h-purin-6-one
  • 6h-purine-6-one, 7,7'-(1,2-ethanediyl)bis(2-amino-1,7-dihydro-
  • diguanylethane
CAS Number(s)
  • 72409-55-3
InChIKey GBXKEXOJSKEPTK-UHFFFAOYSA-N
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