[(2R,3S,5R)-5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrothiophen-2-Yl]Methyl Dihydrogen Phosphate

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Formula C9H14N3O6PS
IUPAC Name [(2r,3s,5r)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrothiophen-2-yl]methyl dihydrogen phosphate
Molecular Mass 323.263 g·mol−1
Heat of Formation -1309.0 ± 16.7 kJ·mol−1
Dipole Moment 8.18 ± 1.08 D
Volume 326.12 Å 3
Surface Area 275.05 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey XBGBVDAACAZVPJ-SHYZEUOFSA-N
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