Geometry & MOs

Info

ID:	139136
PubChem CID:	52480003
Reduced:	SN2O3C19H20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	360.12407
ΔH_f, kcal/mol:	-86.52
Dipole, Da:	8.23
IP(EA), eV:	-9.03(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(3-chlorophenyl)ethyl]-1-(furan-2-carbonyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CSC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(=O)N

DOS

IR

Vibrations