Geometry & MOs

Info

ID:	89485
PubChem CID:	49962065
Reduced:	NOC12H23 (1)
Stoich.:	ABC12D23 (1)
Weight, g/mol:	288.151902
ΔH_f, kcal/mol:	-48.67
Dipole, Da:	2.33
IP(EA), eV:	-9.28(0.9)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2S,6R)-4-benzyl-2,6-bis(prop-2-enyl)-1,2,3,6-tetrahydropyridine;chloride

Drug info:

PubChemData

Smile

CCC(C)[C@H](C(CC=C)(CC=C)O)N

DOS

IR

Vibrations