5-{4-[(4-~11~C)Butylsulfanyl]-1,2,5-Thiadiazol-3-Yl}-1-Methyl-1,2,3,6-Tetrahydropyridine

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Formula C12H19N3S2
IUPAC Name 3-butylsulfanyl-4-[(1r)-1-methyl-3,6-dihydro-2h-pyridin-5-yl]-1,2,5-thiadiazole
Molecular Mass 269.429 g·mol−1
Heat of Formation 186.5 ± 16.7 kJ·mol−1
Dipole Moment 2.10 ± 1.08 D
Volume 339.57 Å 3
Surface Area 280.91 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey SFXHHGRYNXLPKT-BJUDXGSMSA-N
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Elements H S C N