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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.
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.
Afiliação
  • Sheshadri SN; Department of Chemistry, GSSS Institute of Engineering & Technology for Women, Mysuru 570 016, Karnataka, India.
  • Kwong HC; School of Chemical Sciences, Universiti Sains Malaysia, Penang 11800 USM, Malaysia.
  • Chidan Kumar CS; Department of Engineering Chemistry, Vidya Vikas Institute of Engineering & Technology, Visvesvaraya Technological University, Alanahally, Mysuru 570 028, Karnataka, India.
  • Quah CK; X-ray Crystallography Unit, School of Physics, Universiti Sains Malaysia, 11800 USM, Penang, Malaysia.
  • Siddaraju BP; Department of Chemistry, Cauvery Institute of Technology, Mandya 571 402, Karnataka, India.
  • Veeraiah MK; Department of Chemistry, Sri Siddhartha Institute of Technology, Tumkur 572 105, Karnataka, India.
  • Hamid MABA; X-ray Crystallography Unit, School of Physics, Universiti Sains Malaysia, 11800 USM, Penang, Malaysia.
  • Warad I; Department of Chemistry, Science College, An-Najah National University, PO Box 7, Nablus, West Bank, Palestinian Territories.
Acta Crystallogr E Crystallogr Commun ; 74(Pt 5): 752-756, 2018 May 01.
Article em En | MEDLINE | ID: mdl-29850106
ABSTRACT
In the cation of the title salt, C20H19N2O+·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 R22(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.
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Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2018 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2018 Tipo de documento: Article