Geometry & MOs

Info

ID:	8108
PubChem CID:	75021
Reduced:	OI3H5C7 (1)
Stoich.:	AB3C5D7 (1)
Weight, g/mol:	485.7475
ΔH_f, kcal/mol:	19.25
Dipole, Da:	2.27
IP(EA), eV:	-9.21(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-triiodo-3-methylphenol

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1I)I)O)I

DOS

IR

Vibrations