Geometry & MOs

Info

ID:	88973
PubChem CID:	49958426
Reduced:	BrClN2O2H14C17 (1)
Stoich.:	ABC2D2E14F17 (1)
Weight, g/mol:	362.058883
ΔH_f, kcal/mol:	13.51
Dipole, Da:	5.07
IP(EA), eV:	-9.27(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2,4-dichlorophenoxy)ethyl]-5-(2-phenylethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCC2=NN=C(O2)COC3=C(C=C(C=C3)Br)Cl

DOS

IR

Vibrations