Geometry & MOs

Info

ID:	89522
PubChem CID:	49962245
Reduced:	ClNOC17H20 (1)
Stoich.:	ABCD17E20 (1)
Weight, g/mol:	309.06872
ΔH_f, kcal/mol:	-26.4
Dipole, Da:	2.41
IP(EA), eV:	-8.25(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NCCOC2=C(C=C(C=C2)Cl)C

DOS

IR

Vibrations