Geometry & MOs

Info

ID:	231785
PubChem CID:	87574653
Reduced:	NO2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	422.92829
ΔH_f, kcal/mol:	-53.1
Dipole, Da:	4.43
IP(EA), eV:	-8.3(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(2-fluoro-4-iodophenyl)-4-methoxy-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1OC)N(OC)OC)C2=CC=C(C=C2)N

DOS

IR

Vibrations