Geometry & MOs

Info

ID:	146021
PubChem CID:	53624633
Reduced:	ClN3O3C16H20 (1)
Stoich.:	AB3C3D16E20 (1)
Weight, g/mol:	391.225977
ΔH_f, kcal/mol:	-111.82
Dipole, Da:	4.58
IP(EA), eV:	-8.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-1-benzylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N)N(CCOC)C(=O)CC1=CNC2=C1C=CC(=C2)Cl

DOS

IR

Vibrations