Geometry & MOs

Info

ID:	73455
PubChem CID:	48417751
Reduced:	SO3N4C21H24 (1)
Stoich.:	AB3C4D21E24 (1)
Weight, g/mol:	409.112999
ΔH_f, kcal/mol:	-49.29
Dipole, Da:	5.07
IP(EA), eV:	-8.85(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[2-[2-methyl-3-(propylsulfonylamino)anilino]-2-oxoethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=CC(=C1C)NC(=O)C2=CC=C(C=C2)N3C(=CC=N3)C

DOS

IR

Vibrations