Geometry & MOs

Info

ID:	88958
PubChem CID:	49958225
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	467.95072
ΔH_f, kcal/mol:	-17.44
Dipole, Da:	7.79
IP(EA), eV:	-8.89(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,4-dibromophenoxy)methyl]-5-[(2,6-dimethylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OCC2=NN=C(O2)/C=C/C3=CC=C(C=C3)OC

DOS

IR

Vibrations