Geometry & MOs

Info

ID:	432153
PubChem CID:	135172285
Reduced:	I2N2H10C17 (1)
Stoich.:	A2B2C10D17 (1)
Weight, g/mol:	496.88859
ΔH_f, kcal/mol:	132.04
Dipole, Da:	4.17
IP(EA), eV:	-8.64(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-9-(4-iodopyrimidin-2-yl)carbazole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N2C4=NC(=CC=C4)I)C=C(C=C3)I

DOS

IR

Vibrations