Absouline

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Formula C17H22N2O2
IUPAC Name (e)-n-[(1r,4r,8s)-2,3,5,6,7,8-hexahydro-1h-pyrrolizin-1-yl]-3-(4-methoxyphenyl)prop-2-enamide
Molecular Mass 286.369 g·mol−1
Heat of Formation -199.0 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 359.85 Å 3
Surface Area 333.06 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(4-methoxyphenyl)-n-[(1r,8s)-pyrrolizidin-1-yl]acrylamide
  • (e)-n-[(1r,8s)-2,3,5,6,7,8-hexahydro-1h-pyrrolizin-1-yl]-3-(4-methoxyphenyl)prop-2-enamide
CAS Number(s)
  • 112513-33-4
InChIKey SBFIICJNXKHXND-GRLYAWNKSA-N
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