Geometry & MOs

Info

ID:	158412
PubChem CID:	56463589
Reduced:	FSN3O4H20C22 (1)
Stoich.:	ABC3D4E20F22 (1)
Weight, g/mol:	403.156577
ΔH_f, kcal/mol:	-142.54
Dipole, Da:	6.8
IP(EA), eV:	-8.83(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-3-[(3,4-dimethylphenyl)sulfonylamino]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations