Geometry & MOs

Info

ID:	13813
PubChem CID:	398662
Reduced:	ClON3C23H32 (1)
Stoich.:	ABC3D23E32 (1)
Weight, g/mol:	401.22339
ΔH_f, kcal/mol:	-59.41
Dipole, Da:	7.57
IP(EA), eV:	-8.44(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(4-aminophenyl)ethyl]-3-methylpiperidin-4-yl]-N-phenylpropanamide;hydrochloride

Drug info:

PubChemData

Smile

CCC(=O)N(C1CCN(CC1C)CCC2=CC=C(C=C2)N)C3=CC=CC=C3.Cl

DOS

IR

Vibrations