Geometry & MOs

Info

ID:	269698
PubChem CID:	103618672
Reduced:	BrFNOSCl2H5C11 (1)
Stoich.:	ABCDEF2G5H11 (1)
Weight, g/mol:	416.89537
ΔH_f, kcal/mol:	-36.58
Dipole, Da:	3.08
IP(EA), eV:	-9.24(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(4-bromo-2,6-dimethylphenyl)-5-chlorobenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)Br)NC(=O)C2=C(SC(=C2)Cl)Cl

DOS

IR

Vibrations