Geometry & MOs

Info

ID:	353751
PubChem CID:	127285328
Reduced:	ON6C18H24 (1)
Stoich.:	AB6C18D24 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	44.37
Dipole, Da:	8.81
IP(EA), eV:	-9.2(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-4-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2CCN(CC2)CCC3=NN=NN3C4=CC=CC=C4

DOS

IR

Vibrations