Geometry & MOs

Info

ID:	89516
PubChem CID:	49962237
Reduced:	ClON2C21H21 (1)
Stoich.:	ABC2D21E21 (1)
Weight, g/mol:	372.96358
ΔH_f, kcal/mol:	17.62
Dipole, Da:	1.43
IP(EA), eV:	-8.1(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-chloro-N-[2-(4-chloro-2-methylphenoxy)ethyl]aniline

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OCCNC2=CC=C(C=C2)NC3=CC=CC=C3

DOS

IR

Vibrations