Geometry & MOs

Info

ID:	182266
PubChem CID:	76867579
Reduced:	O3N7C26H35 (1)
Stoich.:	A3B7C26D35 (1)
Weight, g/mol:	439.166269
ΔH_f, kcal/mol:	-57.27
Dipole, Da:	9.0
IP(EA), eV:	-8.85(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2-chlorophenyl)methoxy]phenyl]-3-(5-cyano-2,4-dimethyl-6-oxopiperidin-3-yl)propanamide

Drug info:

PubChemData

Smile

CCCCN1C2C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC3=CN(N=C3)CC4=CC=CC=C4)CC(C)C

DOS

IR

Vibrations