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

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Properties Simple | Detailed

Formula C8H9FN2O2S++
IUPAC Name 5-fluoro-1-[(2r)-tetrahydrothiophen-2-yl]pyrimidine-2,4-dione
Molecular Mass 216.233 g·mol−1
Heat of Formation -482.7 ± 16.7 kJ·mol−1
Dipole Moment 5.94 ± 1.08 D
Volume 229.67 Å 3
Surface Area 215.31 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
InChIKey PLCFCSKGIXYEOZ-ZCFIWIBFSA-N
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