Crystal structure and Hirshfeld surface analysis of a pyridiniminium bromide salt: 1-[2-([1,1'-biphen-yl]-4-yl)-2-oxoeth-yl]-3-methyl-1,4-di-hydro-pyridin-4-iminium bromide

In the cation of the title salt, C H N O ·Br , the phenyl rings are inclined to one another by 38.38 (8)°, whereas the central phenyl ring and the pyridiniminium ring are almost perpendicular with a dihedral angle of 87.37 (9)°. The N =C cationic double bond was verified by the shortened bond length...

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Veröffentlicht in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2018-05, Vol.74 (Pt 5), p.752-756
Hauptverfasser: Sheshadri, S N, Kwong, Huey Chong, Chidan Kumar, C S, Quah, Ching Kheng, Siddaraju, B P, Veeraiah, M K, Hamid, Muhammad Aiman Bin Abd, Warad, Ismail
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Sprache:eng
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Zusammenfassung:In the cation of the title salt, C H N O ·Br , the phenyl rings are inclined to one another by 38.38 (8)°, whereas the central phenyl ring and the pyridiniminium ring are almost perpendicular with a dihedral angle of 87.37 (9)°. The N =C cationic double bond was verified by the shortened bond length of 1.337 (2) Å. In the crystal, the Br anion is linked to the cation by an N-H⋯Br hydrogen bond. C-H⋯O hydrogen bonds link adjacent pyridiniminium cations into inversion dimers with an (18) graph-set motif. These dimers are stacked in a phen-yl-phenyl T-shaped geometry through C-H⋯π inter-actions. A Hirshfeld surface analysis was conducted to verify the contributions of the different inter-molecular inter-actions.
ISSN:2056-9890
2056-9890
DOI:10.1107/S2056989018006217