Geometry & MOs

Info

ID:	424196
PubChem CID:	135121714
Reduced:	NOCl3C9H12 (1)
Stoich.:	ABC3D9E12 (1)
Weight, g/mol:	313.85248
ΔH_f, kcal/mol:	-63.96
Dipole, Da:	1.65
IP(EA), eV:	-9.09(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dibromo-3-fluoro-6-nitroaniline

Drug info:

PubChemData

Smile

CNCCOC1=C(C=CC=C1Cl)Cl.Cl

DOS

IR

Vibrations