Geometry & MOs

Info

ID:	153754
PubChem CID:	56313065
Reduced:	S2N3O3C24H27 (1)
Stoich.:	A2B3C3D24E27 (1)
Weight, g/mol:	475.105805
ΔH_f, kcal/mol:	-53.2
Dipole, Da:	3.66
IP(EA), eV:	-8.35(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfamoyl]-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

DOS

IR

Vibrations