Geometry & MOs

Info

ID:	143668
PubChem CID:	53246368
Reduced:	SN3O3C23H31 (1)
Stoich.:	AB3C3D23E31 (1)
Weight, g/mol:	438.161329
ΔH_f, kcal/mol:	-84.48
Dipole, Da:	7.31
IP(EA), eV:	-9.03(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,6R)-1-(benzenesulfonyl)-N-[1-(furan-2-yl)ethyl]-6-phenylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CN(C)C)NC(=O)[C@@H]1CC[C@@H](N(C1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations