Geometry & MOs

Info

ID:	88998
PubChem CID:	49958619
Reduced:	ClN2O3H17C18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	346.072035
ΔH_f, kcal/mol:	-27.52
Dipole, Da:	2.4
IP(EA), eV:	-8.98(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC2=NN=C(O2)COC3=CC=C(C=C3)Cl

DOS

IR

Vibrations