[(2R,3R,4R,5R)-3-Hydroxy-4-(2-Methoxyethoxy)-5-(5-Methyl-4-Oxo-2-Thioxo-Pyrimidin-1-Ium-5-Id-1-Yl)Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C13H21N2O9PS
IUPAC Name [(2r,3r,4r,5r)-3-hydroxy-4-(2-methoxyethoxy)-5-(5-methyl-4-oxo-2-thioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 412.353 g·mol−1
Heat of Formation -1817.4 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 438.35 Å 3
Surface Area 367.19 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
InChIKey BCVUFQXUUOAMEV-DNRKLUKYSA-N
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