(1S,13S)-7-Chloro-15-Ethyl-10-Azatetracyclo[11.3.1.0~2,11~.0~4,9~]Heptadeca-2,4(9),5,7,10,14-Hexaen-3-Amine

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Properties Simple | Detailed

Formula C18H19ClN2
IUPAC Name (1s,13s)-7-chloro-15-ethyl-10-azatetracyclo[11.3.1.0 2,11 .0 4,9 ]heptadeca-2,4(9),5,7,10,14-hexaen-3-amine
Molecular Mass 298.810 g·mol−1
Heat of Formation 99.2 ± 16.7 kJ·mol−1
Dipole Moment 5.93 ± 1.08 D
Volume 356.78 Å 3
Surface Area 299.14 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 3-chloro-9-ethyl-6,7,8,9,10,11-hexahydro-7,11-methanocycloocta[b]quinolin-12-amine
  • hux
InChIKey QTPHSDHUHXUYFE-NWDGAFQWSA-N
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Elements H C N Cl