[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-1,6-Dihydro-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl [(2R,3S,4S)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl Dihydrogen Diphosphate

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Formula C15H25N5O14P2
IUPAC Name 2-amino-9-[(z)-4-hydroxy-5-[[(1s,4s)-2,3,5-trioxa-1-phospha-4-phosphoniabicyclo[2.1.0]pentan-4-yl]oxy]pent-3-en-1-ynyl]-3h-purine-1,7-diium-4-id-6-one; (5e)-5-(hydroxymethylene)-2h-furan-4-ol; pentahydrate
Molecular Mass 561.332 g·mol−1
Heat of Formation -2059.7 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 581.53 Å 3
Surface Area 520.26 Å 2
HOMO Energy -7.70 ± 0.55 eV
LUMO Energy -1.87 ± eV
Point Group Symmetry C1
InChIKey NOLLEWZDVQOFJY-ZVIMGNLFSA-N
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