Geometry & MOs

Info

ID:	89531
PubChem CID:	49962278
Reduced:	ClNOC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	350.956525
ΔH_f, kcal/mol:	-34.34
Dipole, Da:	2.87
IP(EA), eV:	-8.9(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,5-trichloro-N-[2-(4-chlorophenoxy)ethyl]aniline

Drug info:

PubChemData

Smile

C1CCC(=CC1)CCNCCOC2=CC=C(C=C2)Cl

DOS

IR

Vibrations