[(2R,3S,5R)-3-Hydroxy-5-[6-Oxo-2-(Propylamino)-1,8-Dihydropurine-2,3,4,5,7,8-Hexaid-9-Yl]Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Formula C13H26N5O7P
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-[6-oxo-2-(propylamino)-1,8-dihydropurine-2,3,4,5,7,8-hexaid-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 395.349 g·mol−1
Heat of Formation -1368.4 ± 16.7 kJ·mol−1
Dipole Moment 10.34 ± 1.08 D
Volume 418.71 Å 3
Surface Area 380.11 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
InChIKey OWYUJGCLBCUIHH-DJLDLDEBSA-N
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