Geometry & MOs

Info

ID:	346726
PubChem CID:	127271230
Reduced:	FN3O3C17H22 (1)
Stoich.:	AB3C3D17E22 (1)
Weight, g/mol:	360.135304
ΔH_f, kcal/mol:	-106.3
Dipole, Da:	4.26
IP(EA), eV:	-9.22(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C(C)(C)C)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations