Geometry & MOs

Info

ID:	243310
PubChem CID:	99218281
Reduced:	ClSN3O6H20C21 (1)
Stoich.:	ABC3D6E20F21 (1)
Weight, g/mol:	394.136257
ΔH_f, kcal/mol:	-113.51
Dipole, Da:	5.2
IP(EA), eV:	-9.48(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(tert-butylsulfamoyl)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations