Geometry & MOs

Info

ID:	13183
PubChem CID:	222629
Reduced:	IN2O2H5C6 (1)
Stoich.:	AB2C2D5E6 (1)
Weight, g/mol:	263.93957
ΔH_f, kcal/mol:	29.88
Dipole, Da:	7.9
IP(EA), eV:	-9.39(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-4-nitroaniline

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])I)N

DOS

IR

Vibrations