Geometry & MOs

Info

ID:	89061
PubChem CID:	49959074
Reduced:	IN2O3H9C10 (1)
Stoich.:	AB2C3D9E10 (1)
Weight, g/mol:	220.084792
ΔH_f, kcal/mol:	-17.74
Dipole, Da:	1.1
IP(EA), eV:	-8.98(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=NN=C(O2)OC)I

DOS

IR

Vibrations