Geometry & MOs

Info

ID:	122525
PubChem CID:	50810448
Reduced:	N2S2O5C20H22 (1)
Stoich.:	A2B2C5D20E22 (1)
Weight, g/mol:	374.075885
ΔH_f, kcal/mol:	-141.85
Dipole, Da:	6.37
IP(EA), eV:	-8.34(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[ethyl-(4-methylphenyl)sulfonylamino]-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N(C)C1=CC2=C(C=C1)SC(=C2)C(=O)NC3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations