(13S,14E)-14-Ethylidene-12-Methylene-1,10-Diazatetracyclo[11.2.2.0~3,11~.0~4,9~]Heptadeca-3(11),4,6,8-Tetraene

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Formula C18H20N2
IUPAC Name (13s,14e)-14-ethylidene-12-methylene-1,10-diazatetracyclo[11.2.2.0 3,11 .0 4,9 ]heptadeca-3(11),4,6,8-tetraene
Molecular Mass 264.365 g·mol−1
Heat of Formation 265.5 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 335.94 Å 3
Surface Area 280.7 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-apparicine
CAS Number(s)
  • 2122-36-3
InChIKey LCVACABZTLIWCE-CRAFIKPXSA-N
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Elements H C N