Geometry & MOs

Info

ID:	242326
PubChem CID:	96099858
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	316.153541
ΔH_f, kcal/mol:	-116.04
Dipole, Da:	5.81
IP(EA), eV:	-8.58(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-oxo-2-[(2S)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]ethyl]pyridin-2-one

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)N1C2=CC(=C(C=C2N=C1CNC)OC)OC

DOS

IR

Vibrations