5,6-Dihydroxy(~3~H_3_)-5,6-Dihydrothymidine 5'-(Dihydrogen Phosphate)

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Formula C10H14N2O10PT3
IUPAC Name [(2r,3s,5r)-5-[(5r,6s)-5,6-dihydroxy-5-methyl-2,4-dioxo-hexahydropyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 362.247 g·mol−1
Heat of Formation -2186.8 ± 16.7 kJ·mol−1
Dipole Moment 1.27 ± 1.08 D
Volume 357.32 Å 3
Surface Area 295.08 Å 2
HOMO Energy -10.31 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
InChIKey QWAYKDYQHLTLIL-LFOMBHIWSA-N
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