3'-Thiothymidine

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Properties Simple | Detailed

Formula C10H14N2O4S++
IUPAC Name 1-[(2s,4s,5r)-5-(hydroxymethyl)-4-sulfanyl-tetrahydrofuran-2-yl]-5-methyl-pyrimidin-1-ium-5-ide-2,4-dione
Molecular Mass 258.294 g·mol−1
Heat of Formation -707.1 ± 16.7 kJ·mol−1
Dipole Moment 5.37 ± 1.08 D
Volume 290.15 Å 3
Surface Area 260.25 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
InChIKey LNRCBWCMVHSMBJ-CSMHCCOUSA-P
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