(1S,9R,13R)-1-Allyl-10-(Cyclopropylmethyl)-13-Methyl-10-Azatricyclo[7.3.1.0~2,7~]Trideca-2,4,6-Triene-4,13-Diol

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Formula C20H27NO2
IUPAC Name (1s,9r,13r)-1-allyl-10-(cyclopropylmethyl)-13-methyl-10-azatricyclo[7.3.1.0 2,7 ]trideca-2,4,6-triene-4,13-diol
Molecular Mass 313.434 g·mol−1
Heat of Formation -210.1 ± 16.7 kJ·mol−1
Dipole Moment 2.03 ± 1.08 D
Volume 400.71 Å 3
Surface Area 324.79 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.00 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-bc 2860
  • 2,6-methano-3-benzazocine-8,11-diol, 3-(cyclopropylmethyl)-1,2,3,4,5,6-hexahydro-11-methyl-6-(2-propenyl)-, (2r,6s,11r)-
  • 2,6-methano-3-benzazocine-8,11-diol, 3-(cyclopropylmethyl)-1,2,3,4,5,6-hexahydro-11-methyl-6-(2-propenyl)-, (2r-(2alpha,6alpha,11r*))-
  • bc 2860
  • bc 2860, (-)-
  • bc-2860
CAS Number(s)
  • 67710-75-2
  • 68368-77-4
InChIKey SFLZEFJIGARNRQ-AABGKKOBSA-N
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