3-(2-Deoxy-5-O-Phosphono-β-D-Erythro-Pentofuranosyl)-3H-Imidazo[2,1-I]Purine

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Formula C12H15N5O6P
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-(7h-imidazo[2,1-f]purine-1,4,9-triium-7-id-3-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 356.251 g·mol−1
Heat of Formation -997.7 ± 16.7 kJ·mol−1
Dipole Moment 8.29 ± 1.08 D
Volume 356.75 Å 3
Surface Area 303.08 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
InChIKey CACCSKNYAUKFAV-DJLDLDEBSA-P
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