4-Ethoxy-3,8-Dihydroimidazo[2,1-B]Purine-1,5,6-Triium-3A,8-Diide

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Formula C9H10N5O
IUPAC Name 4-ethoxy-3,8-dihydroimidazo[2,1-b]purine-1,5,6-triium-3a,8-diide
Molecular Mass 204.209 g·mol−1
Heat of Formation 238.4 ± 16.7 kJ·mol−1
Dipole Moment 7.20 ± 1.08 D
Volume 226.08 Å 3
Surface Area 222.97 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -1.23 ± eV
Point Group Symmetry Cs
InChIKey ZRHLCYYGBPNSNV-UHFFFAOYSA-O
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