A three-dimensional zinc-based coordination polymer built from 5-carboxylato-1-carboxylatomethyl-2-oxidopyridinium with a 4-connected sra topology

Acta Crystallogr C Struct Chem. 2014 Aug;70(Pt 8):801-4. doi: 10.1107/S2053229614016829. Epub 2014 Jul 31.

Abstract

A novel three-dimensional Zn(II) complex, poly[aqua(μ4-5-carboxylato-1-carboxylatomethyl-2-oxidopyridinium)zinc(II)], [Zn(C8H5NO4)(H2O)]n, has been prepared by hydrothermal assembly of Zn(CH3COO)2·2H2O and 5-carboxy-1-(carboxymethyl)pyridin-1-ium-2-olate (H2ccop). The ccop(2-) anions bridge the Zn(II) cations in a head-to-tail fashion via monodentate aromatic carboxylate and phenolate O atoms to form an extended zigzag chain which runs parallel to the [011] direction. One O atom of the aliphatic carboxylate group of the ccop(2-) ligand coordinates to the Zn(II) atom of a neighbouring chain thereby producing undulating layers which lie parallel to the (01-1) plane. A similar parallel undulating planar structure can be obtained if a path involving the other O atom of the aliphatic carboxylate group is considered. Thus, the aliphatic carboxylate group acts in a bridging bidentate mode to give extended -Zn-O-C-O-Zn- sequences running parallel to [001] which link the layers into an overall three-dimensional framework. The three-dimensional framework can be simplified as a 4-connected sra topology with a Schläfli symbol of 4(2).6(3).8 if all the Zn(II) centres and ccop(2-) anions are regarded as tetrahedral 4-connected nodes. The three-dimensional luminescence spectrum was measured at room temperature with excitation and emission wavelengths of 344-354 and 360-630 nm, respectively, at intervals of 0.15 and 2 nm, respectively.

Keywords: 4-connected sra topology; 5-carboxy-1-(carboxymethyl)pyridin-1-ium-2-olate; crystal structure; luminescence properties; three-dimensional ZnII coordination polymer.