6',7,12-Trimethoxy-2,2'-Dimethylberbaman-6-Ol

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Properties Simple | Detailed

Formula C37H40N2O6
IUPAC Name 6',7,12-trimethoxy-2,2'-dimethylberbaman-6-ol
Molecular Mass 608.723 g·mol−1
Heat of Formation -579.8 ± 16.7 kJ·mol−1
Dipole Moment 5.46 ± 1.08 D
Volume 728.27 Å 3
Surface Area 524.95 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
Synonyms
  • berbaman-6-ol, 6',7,12-trimethoxy-2,2'-dimethyl-
  • cycleabarbatine
CAS Number(s)
  • 152697-36-4
InChIKey JIGFMOPXEDLMPQ-URLMMPGGSA-N
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