Geometry & MOs

Info

ID:	21981
PubChem CID:	594511
Reduced:	NCl4H9C13 (1)
Stoich.:	AB4C9D13 (1)
Weight, g/mol:	320.94596
ΔH_f, kcal/mol:	15.22
Dipole, Da:	2.07
IP(EA), eV:	-8.76(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dichloro-N-[(3,4-dichlorophenyl)methyl]aniline

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CNC2=CC(=C(C=C2)Cl)Cl)Cl)Cl

DOS

IR

Vibrations