Geometry & MOs

Info

ID:	432188
PubChem CID:	135172320
Reduced:	I2N4H8C15 (1)
Stoich.:	A2B4C8D15 (1)
Weight, g/mol:	534.90424
ΔH_f, kcal/mol:	160.46
Dipole, Da:	3.35
IP(EA), eV:	-9.24(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-iodo-6-(3-iodophenyl)benzimidazolo[1,2-a]benzimidazole

Drug info:

PubChemData

Smile

C1=CC2=C(N=C1)N(C3=C2C=CC(=N3)I)C4=NC=CC(=C4)I

DOS

IR

Vibrations