The title compound is a conjugated molecule containing a benzoxazole aromatic fused heterobicycle. The benzoxazole ring system is planar within 0.01 Angstrom. The molecule assumes an approximately flat conformation, the benzoxazole ring system forming dihedral angles of 6.52° (12) and 7.4° (3) with the benzene ring and the nitro group, respectively. In the crystal, molecules are connected by very weak C—H...O hydrogen interactions, forming chains running parallel to the a or c axes. The methyl H atoms are disordered over two sets of sites of equal occupancy rotated by 60° .

2-(4-Methylphenyl)-6-nitro-1,3-benzoxazole

CENTORE, ROBERTO;PICCIALLI, VINCENZO;TUZI, ANGELA
2013

Abstract

The title compound is a conjugated molecule containing a benzoxazole aromatic fused heterobicycle. The benzoxazole ring system is planar within 0.01 Angstrom. The molecule assumes an approximately flat conformation, the benzoxazole ring system forming dihedral angles of 6.52° (12) and 7.4° (3) with the benzene ring and the nitro group, respectively. In the crystal, molecules are connected by very weak C—H...O hydrogen interactions, forming chains running parallel to the a or c axes. The methyl H atoms are disordered over two sets of sites of equal occupancy rotated by 60° .
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11588/548113
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