5-(2-Pyrazinyl)-1,3,4-Oxadiazole-2(3H)-Thione

Molecule SVG Image

Properties Simple | Detailed

Formula C6H4N4OS
IUPAC Name 5-pyrazin-2-yl-3h-1,3,4-oxadiazole-2-thione
Molecular Mass 180.187 g·mol−1
Heat of Formation 307.2 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 186.47 Å 3
Surface Area 191.55 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 1.10 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3,4-oxadiazole-2(3h)-thione, 5-pyrazinyl-
  • 5-(2-pyrazinyl)-3h-1,3,4-oxadiazole-2-thione
  • 5-podt
  • 5-pyrazin-2-yl-[1,3,4]oxadiazole-2-thiol
  • 5-pyrazinyl-1,3,4-oxadiazole-2-thione
CAS Number(s)
  • 37545-39-4
InChIKey SQCVJGZVTWQPQV-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N