Geometry & MOs

Info

ID:	154892
PubChem CID:	56314438
Reduced:	FSN2O3C19H21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	456.05185
ΔH_f, kcal/mol:	-70.86
Dipole, Da:	9.08
IP(EA), eV:	-9.27(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-(dimethylsulfamoyl)-N-[2-(2-fluorophenyl)-2-methylpropyl]benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC(C)(C)C1=CC=CC=C1F)SC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations