(6As)-2,9-Dimethoxy-6-Methyl-5,6,6A,7-Tetrahydro-4H-Dibenzo[De,G]Quinoline-1,10-Diol

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Formula C19H21NO4
IUPAC Name (7s,8s)-2,12-dimethoxy-7-methyl-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinoline-1,13-diol
Molecular Mass 327.374 g·mol−1
Heat of Formation -486.8 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 376.33 Å 3
Surface Area 330.61 Å 2
HOMO Energy -8.09 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • bracteoline
  • tnp00332
CAS Number(s)
  • 25651-04-1
InChIKey PLEOQAHCVRVCDL-ZDUSSCGKSA-N
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