(1S)-1,4-Anhydro-1-(4-Oxo-2-Thioxo-1,2,3,4-Tetrahydro-5-Pyrimidinyl)-D-Ribitol

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Formula C9H14N2O5S++
IUPAC Name 5-[(2s,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-thioxo-1h-pyrimidine-1,3-diium-4-one
Molecular Mass 262.283 g·mol−1
Heat of Formation -802.8 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 275.63 Å 3
Surface Area 247.35 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 1.66 ± eV
Point Group Symmetry C1
InChIKey DDHOXEOVAJVODV-GBNDHIKLSA-P
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