Geometry & MOs

Info

ID:	236413
PubChem CID:	92712775
Reduced:	Cl2N3O4H11C16 (1)
Stoich.:	A2B3C4D11E16 (1)
Weight, g/mol:	355.116821
ΔH_f, kcal/mol:	-19.79
Dipole, Da:	3.41
IP(EA), eV:	-9.46(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-5-(2-ethoxyphenyl)-2-(2-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](OC(=N1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC(=CC=C3)Cl

DOS

IR

Vibrations