[(1R,4S,6S)-4-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-6-Hydroxy-Cyclohex-2-En-1-Yl]Methyl Dihydrogen Phosphate

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Formula C11H16N3O6P
IUPAC Name [(1r,4s,6s)-4-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-6-hydroxy-cyclohex-2-en-1-yl]methyl dihydrogen phosphate
Molecular Mass 317.235 g·mol−1
Heat of Formation -1256.9 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 341.72 Å 3
Surface Area 302.73 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey FKEUOBXNNLEVNG-HLTSFMKQSA-O
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