[2-[(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Methoxy]-3-Phosphonooxy-Propyl] Dihydrogen Phosphate

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Formula C9H17N5O10P2+
IUPAC Name [2-[(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)methoxy]-3-phosphonooxy-propyl] dihydrogen phosphate
Molecular Mass 417.206 g·mol−1
Heat of Formation -2165.4 ± 16.7 kJ·mol−1
Dipole Moment 16.06 ± 1.08 D
Volume 407.05 Å 3
Surface Area 340.59 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
InChIKey CJRYQUMMKLTOHZ-UHFFFAOYSA-P
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