Sempervirene

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Properties Simple | Detailed

Formula C19H16N2
IUPAC Name 16,17,18,19-tetrahydroyohimban-13-ium
Molecular Mass 272.344 g·mol−1
Heat of Formation 383.2 ± 16.7 kJ·mol−1
Dipole Moment 7.88 ± 1.08 D
Volume 323.27 Å 3
Surface Area 295.47 Å 2
HOMO Energy -7.69 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,3,4-tetrahydro-13h-benz(g)indole(2,3-a)pyridocolinium nitrate
  • 2,3,4,13- tetrahydro-1h-benz(g)indolo(2,3-a)quinolizin-6-ium, hydroxide, inner salt
  • oprea1_819229
  • sempervirine
  • sempervirine i
  • sempervirine ii
CAS Number(s)
  • 6882-99-1
  • 549-92-8
InChIKey UQVUEULZDJRMJR-UHFFFAOYSA-N
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Elements H C N