Geometry & MOs

Info

ID:	51330
PubChem CID:	12013977
Reduced:	OI2H24C32 (1)
Stoich.:	AB2C24D32 (1)
Weight, g/mol:	661.99674
ΔH_f, kcal/mol:	99.4
Dipole, Da:	2.25
IP(EA), eV:	-8.75(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis(4-iodophenyl)-2,5-bis(4-methylphenyl)benzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C=C(C=C2C3=CC=C(C=C3)I)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)I

DOS

IR

Vibrations