Geometry & MOs

Info

ID:	66103
PubChem CID:	46491124
Reduced:	O2N3C17H19 (1)
Stoich.:	A2B3C17D19 (1)
Weight, g/mol:	398.176106
ΔH_f, kcal/mol:	-51.52
Dipole, Da:	5.19
IP(EA), eV:	-8.93(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-chlorophenyl)ethyl]-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC(C)C2=CC=CC=N2)NC(=O)C

DOS

IR

Vibrations