Geometry & MOs

Info

ID:	340421
PubChem CID:	127262432
Reduced:	NCl2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	373.230306
ΔH_f, kcal/mol:	4.83
Dipole, Da:	3.39
IP(EA), eV:	-9.22(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(2-chloroethyl)dodecan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC=CC=C1/C=C/CN(CCCl)CC2=CC=CC=C2.Cl

DOS

IR

Vibrations