Geometry & MOs

Info

ID:	250278
PubChem CID:	103095310
Reduced:	N3C4H5 (2)
Stoich.:	A3B4C5 (2)
Weight, g/mol:	242.118591
ΔH_f, kcal/mol:	83.02
Dipole, Da:	2.86
IP(EA), eV:	-9.71(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloropropyl)-5-(2-cyclopentylethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C1=NC=NN1)NC2=NC=NC=C2

DOS

IR

Vibrations