Geometry & MOs

Info

ID:	23821
PubChem CID:	606303
Reduced:	N3H7C12 (1)
Stoich.:	A3B7C12 (1)
Weight, g/mol:	193.063997
ΔH_f, kcal/mol:	172.74
Dipole, Da:	2.57
IP(EA), eV:	-8.95(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminoazulene-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations