1-(2-Deoxy-β-D-Erythro-Pentofuranosyl)-4-Thioxo-3,4-Dihydro-2(1H)-Pyrimidinone

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Formula C9H12N2O4S++
IUPAC Name 1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-thioxo-pyrimidin-2-one
Molecular Mass 244.268 g·mol−1
Heat of Formation -609.5 ± 16.7 kJ·mol−1
Dipole Moment 7.19 ± 1.08 D
Volume 267.71 Å 3
Surface Area 248.3 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
InChIKey PHNDUXLWAVSUAL-BBVRLYRLSA-N
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