Geometry & MOs

Info

ID:	367899
PubChem CID:	127326072
Reduced:	ON5C20H25 (1)
Stoich.:	AB5C20D25 (1)
Weight, g/mol:	387.207053
ΔH_f, kcal/mol:	29.51
Dipole, Da:	6.29
IP(EA), eV:	-8.83(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-3-[4-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]piperidin-2-one

Drug info:

PubChemData

Smile

C1CC(C(=O)N(C1)C2=CC=CC=C2)N3CCC(CC3)NC4=NN=CC=C4

DOS

IR

Vibrations