Geometry & MOs

Info

ID:	274546
PubChem CID:	103810102
Reduced:	F2N3O3H7C12 (1)
Stoich.:	A2B3C3D7E12 (1)
Weight, g/mol:	295.015997
ΔH_f, kcal/mol:	-73.84
Dipole, Da:	7.15
IP(EA), eV:	-9.62(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(6-fluoropyridin-3-yl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)NC2=CN=C(C=C2)F)F

DOS

IR

Vibrations