2-Amino-7-[2-(2-Amino-6-Oxo-3H-Purine-1,9-Diium-5-Id-7-Yl)Ethyl]-3H-Purine-1,9-Diium-5-Id-6-One

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Properties Simple | Detailed

Formula C12H14N10O2
IUPAC Name 2-amino-7-[2-(2-amino-6-oxo-3h-purine-1,9-diium-5-id-7-yl)ethyl]-3h-purine-1,9-diium-5-id-6-one
Molecular Mass 330.305 g·mol−1
Heat of Formation 191.8 ± 16.7 kJ·mol−1
Dipole Moment 0.16 ± 1.08 D
Volume 349.39 Å 3
Surface Area 312.02 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry Ci
InChIKey SHACTZRIAIVGJZ-UHFFFAOYSA-P
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