Geometry & MOs

Info

ID:	61404
PubChem CID:	26708948
Reduced:	NSF2O3H13C15 (1)
Stoich.:	ABC2D3E13F15 (1)
Weight, g/mol:	388.95328
ΔH_f, kcal/mol:	-175.91
Dipole, Da:	7.97
IP(EA), eV:	-9.55(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-fluoro-N-(2-fluoro-5-methylsulfonylphenyl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations