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. 2008 Apr 4;64(Pt 5):o808.
doi: 10.1107/S1600536808008891.

2-Fluoro-anilinium N-(2-fluoro-phenyl)oxamate

2-Fluoro-anilinium N-(2-fluoro-phenyl)oxamate

Orhan Büyükgüngör et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

The crystal structure of the title salt, C(6)H(7)FN(+)·C(8)H(5)FNO(3) (-), exhibits intra-molecular N-H⋯O and C-H⋯O and inter-molecular N-H⋯O and N-H⋯F hydrogen-bond inter-actions, the intra-molecular hydrogen-bond inter-actions generating S(6) and S(5) ring motifs. The dihedral angles between the aromatic ring and the intra-molecular hydrogen-bonded rings in the anion are 2.97 (7) and 6.70 (5)°. The two aromatic rings of the title compound are oriented with a dihedral angle of 77.25 (9)°.

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Figures

Fig. 1.
Fig. 1.
The molecular structure of the title molecule, with the atom-numbering scheme. Displacement ellipsoids are drawn at the 30% probability level. The hydrogen bonds are drawn as dashed lines.
Fig. 2.
Fig. 2.
A partial packing diagram of (I), showing the formation of R12(5)R42(8)R44(12) motifs. H atoms not involved in hydrogen bonds have been omitted for clarity. [Symmetry codes: (i) 1 - x, 1 - y, z; (ii) x, y - 1, z; (iii) -x, y, -z; (iv) 1 - x, -y, -z; (v) -x, -y, -z].
Fig. 3.
Fig. 3.
A partial packing diagram of (I), showing the formation of R22(10) motif. H atoms not involved in hydrogen bonds have been omitted for clarity. [Symmetry code: (i) 1 - x, -y, 1 - z].

References

    1. Bernstein, J., Davis, R. E., Shimoni, L. & Chang, N.-L. (1995). Angew. Chem. Int. Ed. Engl.34, 1555–1573.
    1. Büyükgüngör, O. & Odabaşoğlu, M. (2007). Acta Cryst. E63, o4376–o4377.
    1. Etter, M. C. (1990). Acc. Chem. Res.23, 120–126.
    1. Farrugia, L. J. (1997). J. Appl. Cryst.30, 565.
    1. Farrugia, L. J. (1999). J. Appl. Cryst.32, 837–838.