Geometry & MOs

Info

ID:	182056
PubChem CID:	76834043
Reduced:	NO4C30H43 (1)
Stoich.:	AB4C30D43 (1)
Weight, g/mol:	385.10002
ΔH_f, kcal/mol:	-192.4
Dipole, Da:	6.24
IP(EA), eV:	-9.1(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-cyclopent-2-en-1-ylpiperidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(C)OCC(CNC(C)(C)CC2CC3=CC=CC=C3C2)O)CCCCC(=O)O

DOS

IR

Vibrations