2-(Methylsulfonyl)-5-Phenyl-1,3,4-Thiadiazole

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Properties Simple | Detailed

Formula C9H8N2O2S2
IUPAC Name 2-methylsulfonyl-5-phenyl-1,3,4-thiadiazole
Molecular Mass 240.302 g·mol−1
Heat of Formation -0.1 ± 16.7 kJ·mol−1
Dipole Moment 3.30 ± 1.08 D
Volume 250.34 Å 3
Surface Area 241.05 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy 1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,4-thiadiazole, 2-(methylsulfonyl)-5-phenyl-
  • 2-mesyl-5-phenyl-1,3,4-thiadiazole
CAS Number(s)
  • 86738-35-4
InChIKey AFKSITGTMMVRQX-UHFFFAOYSA-N
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