3-[4-(3-Fluoropropylsulfanyl)-1,2,5-Thiadiazol-3-Yl]-1-Methyl-5,6-Dihydro-2H-Pyridine

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Properties Simple | Detailed

Formula C11H16FN3S2
IUPAC Name 3-(3-fluoropropylsulfanyl)-4-[(1r)-1-methyl-3,6-dihydro-2h-pyridin-5-yl]-1,2,5-thiadiazole
Molecular Mass 273.393 g·mol−1
Heat of Formation 41.6 ± 16.7 kJ·mol−1
Dipole Moment 2.24 ± 1.08 D
Volume 322.97 Å 3
Surface Area 281.6 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[4-(3-fluoropropylthio)-1,2,5-thiadiazol-3-yl]-1-methyl-5,6-dihydro-2h-pyridine
InChIKey NQKPPQNBFQLLIZ-UHFFFAOYSA-N
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Elements H S N C F