Geometry & MOs

Info

ID:	89058
PubChem CID:	49959023
Reduced:	BrN2O3H17C21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	166.037842
ΔH_f, kcal/mol:	10.24
Dipole, Da:	5.36
IP(EA), eV:	-8.76(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(furan-2-yl)-5-methoxy-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC2=NN=C(O2)COC3=CC4=CC=CC=C4C=C3)Br

DOS

IR

Vibrations