Geometry & MOs

Info

ID:	88927
PubChem CID:	49957857
Reduced:	Cl2N2O3H16C18 (1)
Stoich.:	A2B2C3D16E18 (1)
Weight, g/mol:	334.027583
ΔH_f, kcal/mol:	-41.95
Dipole, Da:	4.8
IP(EA), eV:	-9.07(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OCC2=NN=C(O2)COC3=CC(=C(C=C3)Cl)C)Cl

DOS

IR

Vibrations