Phenylethanethioic S-Acid

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Properties Simple | Detailed

Formula C8H8OS
IUPAC Name 2-phenylethanethioic s-acid
Molecular Mass 152.214 g·mol−1
Heat of Formation -71.7 ± 16.7 kJ·mol−1
Dipole Moment 1.33 ± 1.08 D
Volume 185.56 Å 3
Surface Area 185.06 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2-phenylethanethioic s-acid
  • 2-phenylthioacetic acid
  • phenyl thioacetic acid
  • phenylthioacetate
  • phenylthioacetic acid
InChIKey IXOFPUCWZCAFJX-UHFFFAOYSA-N
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