3'-Thiothymidine 5'-(Dihydrogen Phosphate)

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Formula C10H15N2O7PS
IUPAC Name [(2r,3s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-3-sulfanyl-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 338.274 g·mol−1
Heat of Formation -1556.0 ± 16.7 kJ·mol−1
Dipole Moment 4.88 ± 1.08 D
Volume 348.93 Å 3
Surface Area 299.53 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey BORVFKJZAOEGOO-GJMOJQLCSA-N
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