Geometry & MOs

Info

ID:	243291
PubChem CID:	99218207
Reduced:	ClNO3C22H28 (1)
Stoich.:	ABC3D22E28 (1)
Weight, g/mol:	356.246378
ΔH_f, kcal/mol:	-164.74
Dipole, Da:	3.83
IP(EA), eV:	-9.57(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-N-ethyl-1-(2-methylpropyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl

DOS

IR

Vibrations