Geometry & MOs

Info

ID:	16919
PubChem CID:	479876
Reduced:	NOSC13H16 (2)
Stoich.:	ABCD13E16 (2)
Weight, g/mol:	468.190521
ΔH_f, kcal/mol:	-15.05
Dipole, Da:	3.69
IP(EA), eV:	-8.61(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[4-(4-phenylpiperidin-1-yl)-2-thiophen-2-ylbutyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN(CC(CCN1CCC(CC1)C2=CC=CC=C2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations