Geometry & MOs

Info

ID:	89515
PubChem CID:	49962236
Reduced:	NOCl4H13C15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	352.134241
ΔH_f, kcal/mol:	-34.15
Dipole, Da:	2.95
IP(EA), eV:	-8.77(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[2-(4-chloro-2-methylphenoxy)ethyl]-4-N-phenylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OCCNC2=CC(=C(C=C2Cl)Cl)Cl

DOS

IR

Vibrations