Geometry & MOs

Info

ID:	206650
PubChem CID:	80277978
Reduced:	HNC2 (5)
Stoich.:	ABC2 (5)
Weight, g/mol:	174.090546
ΔH_f, kcal/mol:	151.11
Dipole, Da:	8.05
IP(EA), eV:	-10.08(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyanobutan-2-yl)imidazole-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)N2C=CN=C2C#N)C#N

DOS

IR

Vibrations