Geometry & MOs

Info

ID:	154543
PubChem CID:	56314002
Reduced:	FSN3O4H20C22 (1)
Stoich.:	ABC3D4E20F22 (1)
Weight, g/mol:	489.121455
ΔH_f, kcal/mol:	-112.69
Dipole, Da:	6.17
IP(EA), eV:	-8.61(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfamoyl]-N-[[1-(thiophen-2-ylmethyl)piperidin-3-yl]methyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)NS(=O)(=O)C

DOS

IR

Vibrations