Geometry & MOs

Info

ID:	154794
PubChem CID:	56314319
Reduced:	ClON3C21H22 (1)
Stoich.:	ABC3D21E22 (1)
Weight, g/mol:	406.138485
ΔH_f, kcal/mol:	17.47
Dipole, Da:	1.59
IP(EA), eV:	-9.29(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-phenylbutyl)-3-piperidin-1-ylsulfonylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCCC(C)C3=CC=CC=C3

DOS

IR

Vibrations