Geometry & MOs

Info

ID:	89020
PubChem CID:	49958764
Reduced:	ClO2N3H12C15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	314.082205
ΔH_f, kcal/mol:	25.12
Dipole, Da:	1.59
IP(EA), eV:	-9.22(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations