Geometry & MOs

Info

ID:	267385
PubChem CID:	103582068
Reduced:	BrFNOSCl2H5C11 (1)
Stoich.:	ABCDEF2G5H11 (1)
Weight, g/mol:	307.991946
ΔH_f, kcal/mol:	-43.22
Dipole, Da:	6.69
IP(EA), eV:	-9.33(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-(3,5-dichloro-4-fluorophenyl)benzamide

Drug info:

PubChemData

Smile

C1=CSC(=C1Br)C(=O)NC2=CC(=C(C(=C2)Cl)F)Cl

DOS

IR

Vibrations