Geometry & MOs

Info

ID:	9219
PubChem CID:	87213
Reduced:	ClN2H3C8 (1)
Stoich.:	AB2C3D8 (1)
Weight, g/mol:	161.998476
ΔH_f, kcal/mol:	81.95
Dipole, Da:	5.05
IP(EA), eV:	-10.44(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chlorobenzene-1,2-dicarbonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)C#N)C#N

DOS

IR

Vibrations