Geometry & MOs

Info

ID:	275517
PubChem CID:	103816495
Reduced:	BrClN3O3H9C13 (1)
Stoich.:	ABC3D3E9F13 (1)
Weight, g/mol:	361.90246
ΔH_f, kcal/mol:	7.43
Dipole, Da:	3.78
IP(EA), eV:	-9.52(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)-2-chloro-4-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=C(N=C2)Cl)Br

DOS

IR

Vibrations