Geometry & MOs

Info

ID:	88697
PubChem CID:	49956144
Reduced:	Cl2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	354.02603
ΔH_f, kcal/mol:	225.44
Dipole, Da:	8.8
IP(EA), eV:	-8.38(-6.83)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-[(4-bromophenyl)methyl]-2-(4-methoxyphenyl)ethanamine;chloride

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)CNCCCN3C=CN=C3.[Cl-].[Cl-]

DOS

IR

Vibrations