Geometry & MOs

Info

ID:	64677
PubChem CID:	29203840
Reduced:	SN3O6C25H27 (1)
Stoich.:	AB3C6D25E27 (1)
Weight, g/mol:	477.99982
ΔH_f, kcal/mol:	-193.34
Dipole, Da:	2.41
IP(EA), eV:	-8.53(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3OC

DOS

IR

Vibrations