Geometry & MOs

Info

ID:	55381
PubChem CID:	17395314
Reduced:	ClN2O3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	322.168128
ΔH_f, kcal/mol:	-76.7
Dipole, Da:	4.67
IP(EA), eV:	-8.97(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylbenzoyl)-N-phenylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)NC(=O)NCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations