[(2R,3R,4R,5R)-3-Hydroxy-4-[2-(2H-Imidazol-1-Ium-2-Ylium-1-Yl)Ethoxy]-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C15H21N4O9P
IUPAC Name [(2r,3r,4r,5r)-3-hydroxy-4-[2-(2h-imidazol-1-ium-2-ylium-1-yl)ethoxy]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 432.322 g·mol−1
Heat of Formation -1770.3 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 462.7 Å 3
Surface Area 363.68 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 2.68 ± eV
Point Group Symmetry C1
InChIKey WIDKIMZIZVKQGR-HKUMRIAESA-N
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