Isolation and structural characterization of 1,5-benzodiazepinium cation in an inorganic-organic hybrid compound [C12H17N2]3[Bi2Cl9]·2EtOH

Srinivasa Rao, A. ; Babu, Eadi Sunil ; Kumara Swamy, K. C. ; Das, Samar K. (2010) Isolation and structural characterization of 1,5-benzodiazepinium cation in an inorganic-organic hybrid compound [C12H17N2]3[Bi2Cl9]·2EtOH Polyhedron, 29 (6). pp. 1706-1714. ISSN 0277-5387

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Official URL: http://linkinghub.elsevier.com/retrieve/pii/S02775...

Related URL: http://dx.doi.org/10.1016/j.poly.2010.02.014

Abstract

The compound [C12H17N2]3[Bi2Cl9]· 2EtOH (1) has been synthesized from bismuth trichloride and o-phenylenediamine (opda) in ethanol at an aerial ambient condition. This preparation includes the conversion of opda to 2,3-dihydro-1H-1,5-benzodiazepinium cation through its reaction with acetone that is formed in situ from aerial ethanol oxidation. Compound 1 crystallizes in triclinic system (space group P-1). In the crystal structure of 1, the supramolecular hydrogen bonding interactions between [Bi2C9]3- and [C12H17N2]+ play an important role in the stabilization of cationic form of 2,3-dihydro-1H-1,5-benzodiazepine and in obtaining emission signals of the organic moiety, which is otherwise not emissive. Compound [C12H17N2]3[Bi2Cl9]·2(2-PrOH) (2), that has been isolated from 2-propanol (instead of ethanol), is isostructural with compound 1.

Item Type:Article
Source:Copyright of this article belongs to Elsevier Science.
Keywords:Bismuth Dimer; Benzodiazepine; Inorganic-organic Hybrid Compound; Crystal Structure; Supramolecular Interactions
ID Code:29666
Deposited On:23 Dec 2010 05:39
Last Modified:07 Jun 2011 05:19

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