Rhodanine

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Properties Simple | Detailed

Formula C3H3NOS2
IUPAC Name 2-thioxothiazolidin-4-one
Molecular Mass 133.192 g·mol−1
Heat of Formation -67.8 ± 16.7 kJ·mol−1
Dipole Moment 2.27 ± 1.08 D
Volume 137.89 Å 3
Surface Area 144.47 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,4-thiazolidinedione, 2-thio-
  • 2-mercaptothiazolinone
  • 2-sulfanylidene-1,3-thiazolidin-4-one
  • 2-thio-4-ketothiazolidine
  • 2-thioxo-1,3-thiazolidin-4-one
  • 2-thioxo-4-thiazolidinone
  • 4-oxo-2-thionothiazolidine
  • 4-oxo-2-thiothiazolidin
  • 4-oxo-2-thioxothiazoline
  • 4-thiazolidinone, 2-thioxo-
  • 4-thiazolidinone-2-thione
  • 4-thioxo-4-thiazolidone
  • 5-thiazolidinone, 2-thioxo-
  • aminorhodanine deriv
  • rhodanic acid
  • rhodanin
  • rhodanine-related derivatives 17
  • rhodaninic acid
  • rodanin
  • usaf ha-2
CAS Number(s)
  • 141-84-4
  • 38895-62-4
  • 6913-23-1
InChIKey KIWUVOGUEXMXSV-UHFFFAOYSA-N
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