Geometry & MOs

Info

ID:	154168
PubChem CID:	56313571
Reduced:	NSO2C8H9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	469.149384
ΔH_f, kcal/mol:	-109.52
Dipole, Da:	5.04
IP(EA), eV:	-8.33(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfamoyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations