[(2R,3R,4R,5R)-3-Hydroxy-4-[2-(Methylamino)-2-Oxo-Ethoxy]-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C13H20N3O10P
IUPAC Name [(2r,3r,4r,5r)-3-hydroxy-4-[2-(methylamino)-2-oxo-ethoxy]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 409.286 g·mol−1
Heat of Formation -2076.5 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 431.97 Å 3
Surface Area 363.82 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
InChIKey PQERMMDCFWNASH-UGKPPGOTSA-N
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