Geometry & MOs

Info

ID:	210974
PubChem CID:	80878348
Reduced:	ClFON3C13H13 (1)
Stoich.:	ABCD3E13F13 (1)
Weight, g/mol:	278.04582
ΔH_f, kcal/mol:	-34.52
Dipole, Da:	2.93
IP(EA), eV:	-9.0(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-2-methylphenoxy)-2-nitroaniline

Drug info:

PubChemData

Smile

CCNC1=NC=C(C(=N1)OC2=C(C=CC(=C2)Cl)C)F

DOS

IR

Vibrations