Geometry & MOs

Info

ID:	88982
PubChem CID:	49958481
Reduced:	N2O2Cl3H13C17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	377.97707
ΔH_f, kcal/mol:	-14.3
Dipole, Da:	0.56
IP(EA), eV:	-9.11(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromo-3-methylphenoxy)methyl]-5-(4-chlorophenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=NN=C(O2)CCCOC3=C(C=C(C=C3)Cl)Cl)Cl

DOS

IR

Vibrations