Geometry & MOs

Info

ID:	89096
PubChem CID:	49959366
Reduced:	BrCl2N2O3H11C15 (1)
Stoich.:	AB2C2D3E11F15 (1)
Weight, g/mol:	469.97996
ΔH_f, kcal/mol:	-23.03
Dipole, Da:	4.77
IP(EA), eV:	-8.97(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)OCCCC2=NN=C(O2)C3=CC=C(O3)Br

DOS

IR

Vibrations