Geometry & MOs

Info

ID:	369830
PubChem CID:	127336207
Reduced:	S2N3O3C17H27 (1)
Stoich.:	A2B3C3D17E27 (1)
Weight, g/mol:	394.202321
ΔH_f, kcal/mol:	-91.72
Dipole, Da:	3.93
IP(EA), eV:	-9.16(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-chlorophenyl)-1-methoxypropan-2-yl]-4-cyclopentyloxypiperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1C2=NC(=CS2)CNC3CCN(CC3)S(=O)(=O)C4CCOCC4

DOS

IR

Vibrations