Abstract

The asymmetric unit of the title compound, C27H16F2N2O4, consists of two crystallographically independent mol­ecules (A and B). In mol­ecule B, the isoindoline-1,3-dione ring system is disordered over two set of sites with a site-occupancy ratio of 0.658 (12):0.342 (12). In mol­ecule A, the fluoro-substituted benzene rings make dihedral angles of 18.36 (8) and 46.37 (8)° with the central benzene ring, whereas the corresponding angles are 40.90 (8) and 52.89 (9)° in mol­ecule B. The isoindoline ring system in mol­ecule A and the major and minor components of the disordered isoindoline ring system in mol­ecule B make dihedral angles of 58.50 (4), 54.13 (16) and 70.01 (28) °, respectively, with their attached benzene rings, linked through the amide group. An intra­molecular O—H⋯O hydrogen bond generates an S(6) ring in each mol­ecule. In the crystal, mol­ecules are linked by N—H⋯O, C—H⋯F and C—H⋯O hydrogen bonds into sheets lying parallel to the bc plane. The crystal studied was a non-merohedral twin with a refined twin component ratio of 0.9316 (8):0.0684 (8).

Highlights

  • The asymmetric unit of the title compound, C27H16F2N2O4, consists of two crystallographically independent molecules (A and B)

  • In molecule B, the isoindoline-1,3-dione ring system is disordered over two set of sites with a site-occupancy ratio of

  • The crystal studied was a nonmerohedral twin with a refined twin component ratio of

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Summary

Structure Reports

N-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2yl)-4,40 0 -difluoro-50 -hydroxy-1,10 :30 ,10 0 terphenyl-40 -carboxamide. In molecule B, the isoindoline-1,3-dione ring system is disordered over two set of sites with a site-occupancy ratio of. In molecule A, the fluoro-substituted benzene rings make dihedral angles of 18.36 (8) and 46.37 (8). With the central benzene ring, whereas the corresponding angles are 40.90 (8) and 52.89 (9) in molecule B. The isoindoline ring system in molecule A and the major and minor components of the disordered isoindoline ring system in molecule B make dihedral angles of 58.50 (4), 54.13 (16) and. H O hydrogen bond generates an S(6) ring in each molecule. Molecules are linked by N—H O, C—H F and C—H O hydrogen bonds into sheets lying parallel to the bc plane. The crystal studied was a nonmerohedral twin with a refined twin component ratio of

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