1-[(4-Methylphenyl)Sulfonyl]-N-(2-Sulfanylethyl)-D-Prolinamide

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Properties Simple | Detailed

Formula C14H20N2O3S2
IUPAC Name (1r,2r)-1-(p-tolylsulfonyl)-n-(2-sulfanylethyl)pyrrolidine-2-carboxamide
Molecular Mass 328.450 g·mol−1
Heat of Formation -458.9 ± 16.7 kJ·mol−1
Dipole Moment 7.94 ± 1.08 D
Volume 381.31 Å 3
Surface Area 338.2 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-1-(4-methylphenyl)sulfonyl-n-(2-sulfanylethyl)pyrrolidine-2-carboxamide
  • (2r)-n-(2-mercaptoethyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide
  • (2r)-n-(2-mercaptoethyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide
  • n-[tosyl-d-prolinyl]amino-ethanethiol
  • tp2
InChIKey NWUYDTGYTUQMDG-CYBMUJFWSA-N
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