Geometry & MOs

Info

ID:	365638
PubChem CID:	127318359
Reduced:	O3N4C13H14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	360.135304
ΔH_f, kcal/mol:	-34.28
Dipole, Da:	4.19
IP(EA), eV:	-9.4(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=NC=C(C=C1)C2=NOC(=N2)C3CCC(=O)NC3

DOS

IR

Vibrations