(2S,2'S)-1,1'-{Disulfanediylbis[(2S)-2-Methyl-1-Oxo-3,1-Propanediyl]}Di(2-Pyrrolidinecarboxylic Acid)

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Properties Simple | Detailed

Formula C18H28N2O6S2
IUPAC Name (2s)-1-[(2s)-3-[[(2s)-3-[(2s)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxo-propyl]disulfanyl]-2-methyl-propanoyl]pyrrolidine-2-carboxylic acid
Molecular Mass 432.555 g·mol−1
Heat of Formation -1217.2 ± 16.7 kJ·mol−1
Dipole Moment 0.30 ± 1.08 D
Volume 518.78 Å 3
Surface Area 418.34 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C2
Synonyms
  • (2s)-1-[(2s)-3-[(2s)-3-[(2s)-2-carboxy-1-pyrrolidinyl]-2-methyl-3-oxopropyl]disulfanyl-2-methyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid
  • (2s)-1-[(2s)-3-[(2s)-3-[(2s)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxo-propyl]disulfanyl-2-methyl-propanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-3-[(2s)-3-[(2s)-2-carboxypyrrolidin-1-yl]-2-methyl-3-oxopropyl]disulfanyl-2-methylpropanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-3-[(2s)-3-[(2s)-2-carboxypyrrolidin-1-yl]-3-keto-2-methyl-propyl]disulfanyl-2-methyl-propanoyl]proline
InChIKey ZWKRXBCJAUKDCI-MQYQWHSLSA-N
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