Geometry & MOs

Info

ID:	158659
PubChem CID:	56464493
Reduced:	SN3O6C20H25 (1)
Stoich.:	AB3C6D20E25 (1)
Weight, g/mol:	455.131506
ΔH_f, kcal/mol:	-207.32
Dipole, Da:	9.46
IP(EA), eV:	-8.72(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-3-[(3-fluoro-4-methylphenyl)sulfonylamino]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C)NC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations