Geometry & MOs

Info

ID:	89011
PubChem CID:	49958739
Reduced:	N2O3Cl4H14C18 (1)
Stoich.:	A2B3C4D14E18 (1)
Weight, g/mol:	427.93301
ΔH_f, kcal/mol:	-52.56
Dipole, Da:	4.26
IP(EA), eV:	-9.16(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)OCCCC2=NN=C(O2)COC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations