Geometry & MOs

Info

ID:	89112
PubChem CID:	49959478
Reduced:	BrClN2O3H14C17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	367.95633
ΔH_f, kcal/mol:	-24.53
Dipole, Da:	4.78
IP(EA), eV:	-8.97(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromofuran-2-yl)-5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations