Geometry & MOs

Info

ID:	170771
PubChem CID:	75277620
Reduced:	ClN3O3C16H20 (1)
Stoich.:	AB3C3D16E20 (1)
Weight, g/mol:	321.14887
ΔH_f, kcal/mol:	-124.78
Dipole, Da:	4.7
IP(EA), eV:	-9.84(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-N-methyl-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)NCC1=CC=CC=C1Cl)C(=O)C2CCC(=O)NC2

DOS

IR

Vibrations