Geometry & MOs

Info

ID:	3127
PubChem CID:	9190
Reduced:	NH4C6 (2)
Stoich.:	AB4C6 (2)
Weight, g/mol:	180.068748
ΔH_f, kcal/mol:	86.06
Dipole, Da:	4.13
IP(EA), eV:	-9.46(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzo[c]cinnoline

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3N=N2

DOS

IR

Vibrations