Syn-Propanethial-S-Oxide

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Properties Simple | Detailed

Formula C3H6OS
IUPAC Name 1-sulfinylpropane
Molecular Mass 90.144 g·mol−1
Heat of Formation -85.1 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 110.0 Å 3
Surface Area 124.36 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
Synonyms
  • isopropyl 4-(aminocarbonyl)-5-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-3-methyl-2-thiophenecarboxylate
  • propanethial s-oxide
CAS Number(s)
  • 32157-29-2
InChIKey BAZSXBOAXJLRNH-UHFFFAOYSA-N
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