3.8 Article

C-I•••N short contacts as tools for the construction of the crystal packing in the crystal structure of 3,3′-(ethane-1,2-diyl)bis(6-iodo-3,4-dihydro-2H-1,3-benzoxazine)

Publisher

INT UNION CRYSTALLOGRAPHY
DOI: 10.1107/S2056989017005047

Keywords

crystal structure; short contacts; benzoxazines; phenolic resins

Funding

  1. Direccion de Investigaciones, Sede Bogota (DIB) de la Universidad Nacional de Colombia [35816]

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The asymmetric unit of the title compound, C18H18I2N2O2, consists of one half-molecule, completed by the application of inversion symmetry. The molecule adopts the typical structure for this class of bis-benxozazines, characterized by an anti orientation of the two benzoxazine rings around the central C-C bond. The oxazinic ring adopts a half-chair conformation. In the crystal, molecules are linked by C-I center dot center dot center dot N short contacts [I center dot center dot center dot N = 3.378 (2) angstrom], generating layers lying parallel to the bc plane.

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