Geometry & MOs

Info

ID:	405415
PubChem CID:	135073858
Reduced:	IOH19C25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	267.91519
ΔH_f, kcal/mol:	81.48
Dipole, Da:	2.9
IP(EA), eV:	-8.57(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-iodo-4-methylphenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=CCOC2=C(C3=CC=CC=C3C=C2)I)C4=CC=CC=C4

DOS

IR

Vibrations