Geometry & MOs

Info

ID:	65163
PubChem CID:	29204551
Reduced:	FSN2O5C23H23 (1)
Stoich.:	ABC2D5E23F23 (1)
Weight, g/mol:	492.01547
ΔH_f, kcal/mol:	-180.82
Dipole, Da:	8.83
IP(EA), eV:	-8.04(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-fluoro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CC2=CC(=C(C=C2)OC)F)S(=O)(=O)NC3=CC=C(C=C3)OC

DOS

IR

Vibrations