Geometry & MOs

Info

ID:	89008
PubChem CID:	49958720
Reduced:	Cl2N2O2C15H16 (1)
Stoich.:	A2B2C2D15E16 (1)
Weight, g/mol:	427.93301
ΔH_f, kcal/mol:	-36.51
Dipole, Da:	2.25
IP(EA), eV:	-9.27(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenoxy)methyl]-5-[(2,4-dichlorophenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=NN=C(O2)COC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations