5-Fluoro-1-(1-Oxidotetrahydro-2-Thiophenyl)-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C8H9FN2O3S++
IUPAC Name 5-fluoro-1-[(1s,2r)-1-oxothiolan-2-yl]pyrimidine-2,4-dione
Molecular Mass 232.232 g·mol−1
Heat of Formation -595.0 ± 16.7 kJ·mol−1
Dipole Moment 6.22 ± 1.08 D
Volume 240.92 Å 3
Surface Area 223.16 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
InChIKey JIDDFPFGMDDOLO-BAHMLBHCSA-N
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