2-Amino-4-(4-bromophenyl)-6-methoxy-4H-benzo[h]chromene-3-carbonitrile

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Abstract

In the title compound, C21H15BrN2O 2, the 14 non-H atoms of the 4H-benzo[h]chromene fused-ring system are approximately coplanar (r.m.s. deviation = 0.129 Å). Within this system, the 4H-pyran ring adopts a flattened half-chair conformation with the methine C atom lying 0.281 (4) Å above the plane of the remaining atoms (r.m.s. deviation = 0.0446 Å). The bromobenzene ring is almost perpendicular to the fused-ring system [dihedral angle = 85.34 (13)°]. In the crystal, supramolecular layers parallel to (101) are sustained by amine-cyano N-H⋯N and amine-methoxy N-H⋯O hydrogen bonds. The layers stack with interactions of the type (bromobenzene)C-H⋯π(outer- C6 ring of the fused-ring system) connecting them.

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Al-Dies, A. A. M., El-Agrody, A. M., Al-Omar, M. A., Amr, A. E. G. E., Ng, S. W., & Tiekink, E. R. T. (2013). 2-Amino-4-(4-bromophenyl)-6-methoxy-4H-benzo[h]chromene-3-carbonitrile. Acta Crystallographica Section E: Structure Reports Online, 69(4). https://doi.org/10.1107/S1600536813005461

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