[(2R,3S,5R)-3-Hydroxy-5-(10-Oxo-5,6,7,8-Tetrahydropyrimido[1,2-A]Purine-1,4-Diium-3-Yl)Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Formula C13H18N5O7P
IUPAC Name [(2r,3s,5r)-3-hydroxy-5-(10-oxo-5,6,7,8-tetrahydropyrimido[1,2-a]purine-1,4-diium-3-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 387.285 g·mol−1
Heat of Formation -1312.4 ± 16.7 kJ·mol−1
Dipole Moment 10.65 ± 1.08 D
Volume 399.82 Å 3
Surface Area 359.4 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
InChIKey MRXXZOXGRDPVAG-DJLDLDEBSA-P
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