Entadamide A

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Properties Simple | Detailed

Formula C6H11NO2S
IUPAC Name (e)-n-(2-hydroxyethyl)-3-methylsulfanyl-prop-2-enamide
Molecular Mass 161.222 g·mol−1
Heat of Formation -326.7 ± 16.7 kJ·mol−1
Dipole Moment 2.75 ± 1.08 D
Volume 198.78 Å 3
Surface Area 203.69 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-n-(2-hydroxyethyl)-3-(methylthio)acrylamide
  • (e)-n-(2-hydroxyethyl)-3-(methylthio)prop-2-enamide
  • (e)-n-(2-hydroxyethyl)-3-methylsulfanyl-prop-2-enamide
  • (e)-n-(2-hydroxyethyl)-3-methylsulfanylprop-2-enamide
  • 2-propenamide, n-(2-hydroxyethyl)-3-(methylthio)-, (e)-
  • n-(2-hydroxyethyl)-3-methylthiopropenamide
CAS Number(s)
  • 100477-88-1
InChIKey NBRCIHAGNJRRRI-GORDUTHDSA-N
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