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

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Formula C13H26N5O9P
IUPAC Name [(2r,3s,4r,5r)-5-(2-amino-6-oxo-1,8-dihydropurine-2,3,4,5,7,8-hexaid-9-yl)-4-hydroxy-3-(2-methoxyethoxy)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 427.347 g·mol−1
Heat of Formation -1658.7 ± 16.7 kJ·mol−1
Dipole Moment 8.93 ± 1.08 D
Volume 440.24 Å 3
Surface Area 382.61 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey ICKYKWCJEMPHMX-WOUKDFQISA-N
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