Geometry & MOs

Info

ID:	441558
PubChem CID:	135236135
Reduced:	SN2O3H10C11 (2)
Stoich.:	AB2C3D10E11 (2)
Weight, g/mol:	525.048684
ΔH_f, kcal/mol:	-132.26
Dipole, Da:	12.28
IP(EA), eV:	-9.0(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(1-benzothiophen-5-ylsulfonyl)phenyl]-6-(methanesulfonamido)indole-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=CN=C1)S(=O)(=O)C2=CC=CC(=C2)N3C(=CC4=C3C=C(C=C4)NS(=O)(=O)C)C(=O)N

DOS

IR

Vibrations