(2S,3S)-2,3-Dihydroxy-4-Sulfanyl-1-Butanesulfonate

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Properties Simple | Detailed

Formula C4H9O5S2-
IUPAC Name (2s,3s)-2,3-dihydroxy-4-sulfanyl-butane-1-sulfonate
Molecular Mass 201.241 g·mol−1
Heat of Formation -228.6 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 146.78 Å 3
Surface Area 140.1 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -2.41 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-2,3-dihydroxy-4-mercapto-butane-1-sulfonate
  • (2s,3s)-2,3-dihydroxy-4-mercaptobutane-1-sulfonate
  • (2s,3s)-2,3-dihydroxy-4-sulfanyl-butane-1-sulfonate
  • dt3
InChIKey BJXWUWDPCVAQDI-QWWZWVQMSA-M
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