(3S)-3-[2-(Methylsulfanyl)Ethyl]-2,5-Piperazinedione

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Properties Simple | Detailed

Formula C7H12N2O2S
IUPAC Name (3s)-3-(2-methylsulfanylethyl)piperazine-2,5-dione
Molecular Mass 188.247 g·mol−1
Heat of Formation -354.8 ± 16.7 kJ·mol−1
Dipole Moment 1.78 ± 1.08 D
Volume 223.53 Å 3
Surface Area 214.99 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-(2-methylsulfanylethyl)piperazine-2,5-dione
  • (3s)-3-[2-(methylthio)ethyl]piperazine-2,5-dione
  • (3s)-3-[2-(methylthio)ethyl]piperazine-2,5-quinone
  • 2,5-piperazinedione, 3-(2-(methylthio)ethyl)-, (s)-
  • cyclo-l-methionylglycine
  • cyclo-met-gly
  • cyclo-methionylglycine
CAS Number(s)
  • 61243-37-6
InChIKey BYJGBWBCRKWFFX-YFKPBYRVSA-N
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