Geometry & MOs

Info

ID:	89490
PubChem CID:	49962074
Reduced:	NC15H27 (1)
Stoich.:	AB15C27 (1)
Weight, g/mol:	242.167552
ΔH_f, kcal/mol:	-20.08
Dipole, Da:	2.12
IP(EA), eV:	-8.96(1.28)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2S,6R)-6-hexyl-2-prop-2-enyl-1,2,3,6-tetrahydropyridine;chloride

Drug info:

PubChemData

Smile

CCCCCC[C@@H]1C=C(C[C@@H](N1)CC=C)C

DOS

IR

Vibrations