Geometry & MOs

Info

ID:	89098
PubChem CID:	49959368
Reduced:	Cl2N2O3C20H20 (1)
Stoich.:	A2B2C3D20E20 (1)
Weight, g/mol:	366.033811
ΔH_f, kcal/mol:	-54.86
Dipole, Da:	5.41
IP(EA), eV:	-8.76(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,4-dichlorophenoxy)propyl]-5-(4-fluorophenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)CCCOC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations