Geometry & MOs

Info

ID:	89223
PubChem CID:	49960054
Reduced:	BrN2O3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	348.01095
ΔH_f, kcal/mol:	-31.11
Dipole, Da:	3.48
IP(EA), eV:	-9.0(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC2=NN=C(O2)COC3=C(C=C(C=C3C)Br)C

DOS

IR

Vibrations