[1-[[9-[(2S,4As,6R,7R,7As)-2,7-Dihydroxy-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-6-Yl]Purine-1,3,7-Triium-6-Yl]Carbamoyl]-2-Ethoxy-2-Oxo-Ethyl]-Λ1-Azanyl-Azanide

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Formula C15H20N7O9P
IUPAC Name [1-[[9-[(2s,4as,6r,7r,7as)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]purine-1,3,7-triium-6-yl]carbamoyl]-2-ethoxy-2-oxo-ethyl]-λ1-azanyl-azanide
Molecular Mass 473.335 g·mol−1
Heat of Formation -1287.9 ± 16.7 kJ·mol−1
Dipole Moment 7.81 ± 1.08 D
Volume 475.96 Å 3
Surface Area 421.27 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -1.14 ± eV
Point Group Symmetry C1
InChIKey SJTCHRTZYRQMOA-ZHIOBFPDSA-O
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