Geometry & MOs

Info

ID:	264552
PubChem CID:	103469411
Reduced:	H5N7C11 (1)
Stoich.:	A5B7C11 (1)
Weight, g/mol:	209.070145
ΔH_f, kcal/mol:	184.53
Dipole, Da:	12.81
IP(EA), eV:	-9.64(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1N)C#N)N2C=NC(=C2C#N)C#N

DOS

IR

Vibrations