Geometry & MOs

Info

ID:	39099
PubChem CID:	8139696
Reduced:	ION2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	378.017412
ΔH_f, kcal/mol:	18.82
Dipole, Da:	5.26
IP(EA), eV:	-9.22(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(2-chlorophenoxy)acetate

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)I

DOS

IR

Vibrations