Geometry & MOs

Info

ID:	89013
PubChem CID:	49958743
Reduced:	BrCl2N2O3H13C17 (1)
Stoich.:	AB2C2D3E13F17 (1)
Weight, g/mol:	383.983525
ΔH_f, kcal/mol:	-25.13
Dipole, Da:	3.45
IP(EA), eV:	-9.13(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC2=NN=C(O2)COC3=C(C=C(C=C3)Cl)Cl)Br

DOS

IR

Vibrations