3-(2,3-Dihydroxypropyl)Thymidine

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Formula C13H20N2O7
IUPAC Name 3-[(2s)-2,3-dihydroxypropyl]-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
Molecular Mass 316.307 g·mol−1
Heat of Formation -1303.5 ± 16.7 kJ·mol−1
Dipole Moment 5.42 ± 1.08 D
Volume 357.36 Å 3
Surface Area 312.67 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
InChIKey WKLMBYZLVVUCQQ-UKKRHICBSA-N
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