“…Oxazepine was synthesized by cycloaddition reaction which is a type of pericyclic reaction [2].The importance of 1,3-oxazepine is ascribed to their applications as anticonvulsant [3][4][5][6][7], antidepressant [8], skeletal muscle relaxants [9], neuroleptic [10], antitumor agent [11], antibacterial [12], anti-corrosion [13], anti-anxiety [14]. Many researchers were reported the synthesis of 1,3-oxazepine by either maleic anhydride or phthalic anhydride [15][16][17].The novelty of the present paper is the synthesis two core 1,3-oxazepine in same molecule by using substitute phthalic anhydrides and DFT Study of 4,4′-oxydianiline Imines as precursors of tetrahalo-1,3-oxazepine to calculate the energies of the HOMO and LUMO orbitals used to predict some physical properties of Schiff bases M1-M4, such as hardness, electron affinity A, Ionization potential I, absolute electronegativity μ, absolute hardness η, and electrophilicity w, stability and aromaticity.…”