Geometry & MOs

Info

ID:	207770
PubChem CID:	80446982
Reduced:	FNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	294.149891
ΔH_f, kcal/mol:	-86.36
Dipole, Da:	1.74
IP(EA), eV:	-9.38(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-chlorophenyl)piperazin-1-yl]-3-methylpentan-2-one

Drug info:

PubChemData

Smile

CCC(C)C(COCC1=CC=CC=C1F)N

DOS

IR

Vibrations