S-(3-Aminopropyl) Hydrogen Sulfurothioate

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Properties Simple | Detailed

Formula C3H9NO3S2
IUPAC Name 1-amino-3-sulfosulfanyl-propane
Molecular Mass 171.238 g·mol−1
Heat of Formation -510.8 ± 16.7 kJ·mol−1
Dipole Moment 2.75 ± 1.08 D
Volume 183.04 Å 3
Surface Area 187.55 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy -1.77 ± eV
Point Group Symmetry C1
Synonyms
  • 1-amino-3-(sulfothio)propane
  • 1-amino-3-sulfosulfanylpropane
  • 1-propanethiol, 3-amino-, hydrogen sulfate (ester)
  • aminopropyl thiosulfuric acid
  • s-(3-aminopropyl)thiosulfate
  • s-(3-aminopropyl)thiosulfuric acid ester
  • thiosulfuric acid, 3-aminopropyl ester
CAS Number(s)
  • 13286-24-3
InChIKey DQYVZPQBQAIGNV-UHFFFAOYSA-N
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