Geometry & MOs

Info

ID:	250621
PubChem CID:	103097937
Reduced:	ON2F3H9C13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	313.006575
ΔH_f, kcal/mol:	-123.68
Dipole, Da:	5.78
IP(EA), eV:	-9.44(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(2,6-difluoropyridin-3-yl)-5-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NC2=C(N=C(C=C2)F)F)F

DOS

IR

Vibrations