Geometry & MOs

Info

ID:	353754
PubChem CID:	127285331
Reduced:	SO2N6C18H22 (1)
Stoich.:	AB2C6D18E22 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	0.33
Dipole, Da:	6.13
IP(EA), eV:	-8.99(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C=CS2)N3C1=NN=C3CN4CCC(CC4)N5CCCC5=O

DOS

IR

Vibrations