Geometry & MOs

Info

ID:	121469
PubChem CID:	50769444
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	26.19
Dipole, Da:	4.12
IP(EA), eV:	-8.26(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-4-[3-[4-(4-methylpiperidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=CC=C(C=C2)C3=NOC(=N3)COC4=CC=CC=C4

DOS

IR

Vibrations