Geometry & MOs

Info

ID:	4919
PubChem CID:	12276
Reduced:	NH2C4 (2)
Stoich.:	AB2C4 (2)
Weight, g/mol:	128.037448
ΔH_f, kcal/mol:	88.51
Dipole, Da:	3.83
IP(EA), eV:	-10.7(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzene-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations