[(2S,3S,5R)-3-Azido-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl [(2S,5R)-5-(6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate

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Formula C20H27N9O9P+++
IUPAC Name [(2s,3s,5r)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl [(2s,5r)-5-(6-oxo-3h-purine-1,7-diium-4-id-9-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate
Molecular Mass 568.457 g·mol−1
Heat of Formation -1309.6 ± 16.7 kJ·mol−1
Dipole Moment 11.26 ± 1.08 D
Volume 589.85 Å 3
Surface Area 421.44 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
InChIKey FHIROJPAHYXZFT-VQJWOFKYSA-R
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