Geometry & MOs

Info

ID:	360728
PubChem CID:	127301373
Reduced:	O2F3N4C18H23 (1)
Stoich.:	A2B3C4D18E23 (1)
Weight, g/mol:	332.14601
ΔH_f, kcal/mol:	-225.6
Dipole, Da:	6.5
IP(EA), eV:	-8.93(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)C2CCCN(C2)C3CCN(C3=O)CC(F)(F)F

DOS

IR

Vibrations