Geometry & MOs

Info

ID:	173828
PubChem CID:	75689312
Reduced:	FSN2O3C13H15 (1)
Stoich.:	ABC2D3E13F15 (1)
Weight, g/mol:	385.218784
ΔH_f, kcal/mol:	-116.83
Dipole, Da:	5.68
IP(EA), eV:	-9.18(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-4-yl)-2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]propanamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C2=C(C1=NN3CCOCC3)C=C(C=C2)F

DOS

IR

Vibrations