Geometry & MOs

Info

ID:	4166
PubChem CID:	10893
Reduced:	INC6H6 (1)
Stoich.:	ABC6D6 (1)
Weight, g/mol:	218.9545
ΔH_f, kcal/mol:	36.62
Dipole, Da:	3.28
IP(EA), eV:	-8.6(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-iodoaniline

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N)I

DOS

IR

Vibrations