(2R,3S,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-2-(Hydroxymethyl)Tetrahydro-3-Furanyl [(2R,3S,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-3-Hydroxytetrahydro-2-Furanyl]Methyl Hydrogen Phosphate

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Properties Simple | Detailed

Formula C20H25N10O10P
IUPAC Name [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
Molecular Mass 596.447 g·mol−1
Heat of Formation -1621.5 ± 16.7 kJ·mol−1
Dipole Moment 25.71 ± 1.08 D
Volume 608.08 Å 3
Surface Area 459.68 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey KGXGIPRRDQWVET-WGWHJZDNSA-N
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