5,6-Dihydroxy-5,6-Dihydrothymidine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C10H17N2O10P
IUPAC Name [(2r,3s,5r)-5-[(5s,6r)-5,6-dihydroxy-5-methyl-2,4-dioxo-hexahydropyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 356.223 g·mol−1
Heat of Formation -2192.0 ± 16.7 kJ·mol−1
Dipole Moment 4.35 ± 1.08 D
Volume 365.83 Å 3
Surface Area 308.89 Å 2
HOMO Energy -10.52 ± 0.55 eV
LUMO Energy -0.49 ± eV
Point Group Symmetry C1
InChIKey QWAYKDYQHLTLIL-ZTOQJESFSA-N
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