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

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Properties Simple | Detailed

Formula C8H9FN2O4S
IUPAC Name 1-(1,1-dioxidotetrahydro-2-thiophenyl)-5-fluoro-2,4(1h,3h)-pyrimidinedione
Molecular Mass 248.231 g·mol−1
Heat of Formation -804.2 ± 16.7 kJ·mol−1
Dipole Moment 7.87 ± 1.08 D
Volume 245.79 Å 3
Surface Area 226.51 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy 2.21 ± eV
Point Group Symmetry C1
InChIKey YUPJZHWEUDXVQY-ZCFIWIBFSA-P
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