New Quasi-One-Dimensional Organic-Inorganic Hybrid Material: 1, 3-Bis(4-piperidinium)propane Pentachlorobismuthate(III) Synthesis, Crystal Structure, and Spectroscopic Studies. (1st June 2014)

• Record Type: Journal Article
• Authors: Ferjani, Hela; Boughzala, Habib
• Other Names: Julien Christian M. Academic Editor.
• Is Part Of: Journal of materials. Volume 2014(2014)
• Publication Date: 2014-06-01
• Subjects: Materials -- Periodicals; Materials; Periodicals; 620.11
• DOI: 10.1155/2014/253602
• Languages: English
• ISSNs: 2314-4866

Abstract

Abstract : The organic-inorganic hybrid compound (C13 H28 N2 ) BiCl5 was synthesized by solvothermal method. The crystal structure was solved by single-crystal X-ray diffraction. The compound crystallizes in the orthorhombic system space group Cmc21 with a = 15.826 (4) Å, b = 18.746 (6) Å, c = 7.470 (3) Å, and Z = 4 . The crystal structure was refined down to R = 0.019 . It consists of corrugated layers of [BiCl5 ] 2− chains, separated by organic [H2 TMDP] 2+ cations (TMDP=1, 3-Bis(4-piperidyl)propane = C13 H26 N2 ). The crystal cohesion is achieved by hydrogen bonds N–H ⋯ Cl joining the organic and inorganic layers. The influence of the organic cations' flexibility is discussed. Raman and infrared spectra of the title compound were recorded in the range of 50–400 and 400–4000 cm −1, respectively. Semiempirical parameter model three (PM3) method has been performed to derive the calculated IR spectrum. The crystal shape morphology was simulated using the Bravais-Friedel and Donnay-Harker model.