Geometry & MOs

Info

ID:	8093
PubChem CID:	74946
Reduced:	ClNC5H7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	232.053404
ΔH_f, kcal/mol:	-3.85
Dipole, Da:	3.19
IP(EA), eV:	-8.36(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N,4-N-bis(2-chloroethyl)benzene-1,4-diamine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N)N(CCCl)CCCl

DOS

IR

Vibrations