Construction and photoluminescence properties of a three-dimensional ZnII coordination network based on naphthalene-1,4-dicarboxylic acid and 1,6-bis(pyridin-3-yl)-1,3,5-hexatriene

2018 ◽  
Vol 74 (9) ◽  
pp. 1053-1057 ◽  
Author(s):  
Qian-Kun Zhou ◽  
Lin Wang ◽  
Yun Xu ◽  
Ni-Ya Li
Keyword(s):  
Dicarboxylic Acid ◽  
Self Assembly ◽  
Three Dimensional ◽  
Square Lattice ◽  
Photoluminescence Properties ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Pyridyl Ligands ◽  
Connected Node

In recent years, coordination polymers constructed from multidentate carboxylate and pyridyl ligands have attracted much attention because these ligands can adopt a rich variety of coordination modes and thus lead to the formation of crystalline products with intriguing structures and interesting properties. A new coordination polymer, namely poly[[μ2-1,6-bis(pyridin-3-yl)-1,3,5-hexatriene-κ2 N:N′](μ3-naphthalene-1,4-dicarboxylato-κ4 O 1,O 1′:O 4:O 4′)zinc(II)], [Zn(C12H6O4)(C16H14N2)] n , has been prepared by the self-assembly of Zn(NO3)2·6H2O, naphthalene-1,4-dicarboxylic acid (1,4-H2ndc) and 1,6-bis(pyridin-3-yl)-1,3,5-hexatriene (3,3′-bphte) under hydrothermal conditions. The title compound has been structurally characterized by IR spectroscopy, elemental analysis, powder X-ray diffraction and single-crystal X-ray diffraction analysis. Each ZnII ion is six-coordinated by four O atoms from three 1,4-ndc2− ligands and by two N atoms from two 3,3′-bphte ligands, forming a distorted octahedral ZnO4N2 coordination geometry. Pairs of ZnII ions are linked by 1,4-ndc2− ligands, leading to the formation of a two-dimensional square lattice (sql) layer extending in the ab plane. In the crystal, adjacent layers are further connected by 3,3′-bphte bridges, generating a three-dimensional architecture. From a topological viewpoint, if each dinuclear zinc unit is considered as a 6-connected node and the 1,4-ndc2− and 3,3′-bphte ligands are regarded as linkers, the structure can be simplified as a unique three-dimensional 6-connected framework with the point symbol 446108. The thermal stability and solid-state photoluminescence properties have also been investigated.

Construction of a three-dimensional supramolecular framework based on an anionic cadmium(II) coordination network and protonated dipyridine organic cations

2018 ◽  
Vol 74 (8) ◽  
pp. 889-893
Author(s):  
Qian-Kun Zhou ◽  
Lin Wang ◽  
Dong Liu
Keyword(s):  
Hydrogen Bonding ◽  
Self Assembly ◽  
Title Compound ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Coordination Network ◽  
Hydrogen Bonding Interactions ◽  
Point Symbol

As a class of multifunctional materials, crystalline supramolecular complexes have attracted much attention because of their unique architectures, intriguing topologies and potential applications. In this article, a new supramolecular compound, namely catena-poly[4,4′-(buta-1,3-diene-1,4-diyl)dipyridin-1-ium [(μ4-benzene-1,2,4,5-tetracarboxylato-κ6 O 1,O 1′:O 2:O 4,O 4′:O 5)cadmium(II)]], {(C14H14N2)[Cd(C10H2O8)]} n or {(1,4-H2bpbd)[Cd(1,2,4,5-btc)]} n , has been prepared by the self-assembly of Cd(NO3)2·4H2O, benzene-1,2,4,5-tetracarboxylic acid (1,2,4,5-H4btc) and 1,4-bis(pyridin-4-yl)buta-1,3-diene (1,4-bpbd) under hydrothermal conditions. The title compound has been structurally characterized by IR spectroscopy, elemental analysis, powder X-ray diffraction and single-crystal X-ray diffraction analysis. Each CdII centre is coordinated by six O atoms from four different (1,2,4,5-btc)4− tetraanions. Each CdII cation, located on a site of twofold symmetry, binds to four carboxylate groups belonging to four separate (1,2,4,5-btc)4− ligands. Each (1,2,4,5-btc)4− anion, situated on a position of \overline{1} symmetry, binds to four crystallographically equivalent CdII centres. Neighbouring CdII cations interconnect bridging (1,2,4,5-btc)4− anions to form a three-dimensional {[Cd(1,2,4,5-btc)]2−} n anionic coordination network with infinite tubular channels. The channels are visible in both the [1\overline{1}0] and the [001] direction. Such a coordination network can be simplified as a (4,4)-connected framework with the point symbol (4284)(4284). To balance the negative charge of the metal–carboxylate coordination network, the cavities of the network are occupied by protonated (1,4-H2bpbd)2+ cations that are located on sites of twofold symmetry. In the crystal, there are strong hydrogen-bonding interactions between the anionic coordination network and the (1,4-H2bpbd)2+ cations. Considering the hydrogen-bonding interactions, the structure can be further regarded as a three-dimensional (4,6)-connected supramolecular architecture with the point symbol (4264)(42687·84). The thermal stability and photoluminescence properties of the title compound have been investigated.

Structure of the collagen fibril: some variations on a theme of tetragonally packed dimers

1980 ◽  
Vol 209 (1175) ◽  
pp. 275-297 ◽  
Keyword(s):  
Self Assembly ◽  
Collagen Fibril ◽  
Three Dimensional ◽  
Local Property ◽  
Square Lattice ◽  
Dimensional Structure ◽  
X Ray Diffraction ◽  
X Ray ◽  
Variations On A Theme ◽  
Overlap Region

A theory of the three-dimensional structure of the collagen fibril outlined by Woodhead-Galloway (1977) is discussed in greater detail and an account of the low angle X-ray diffraction pattern (Miller & Wray 1971) is obtained. Square-packed dimers form the overlap region of the fibril. In the gap region, clusters of four dimers at each of the points of a square lattice of side 3.8 nm provide the structure. Molecules are parallel to the axis of the fibril in the overlap region and tilted from the axis by a few degrees in the gap region. A brief discussion of some aspects of the self assembly of such a structure is included. In particular, it is noted that the axially projected D ( ═ 66.8 nm) period, which is a property of the Whole fibril, is not necessarily also a local property; there may be no well defined and finite small grouping of molecules that is itself D -periodic, such as is proposed in the microfibril model of the fibril (Smith 1968). On the other hand, there is strong circumstantial evidence of a D -periodic crystallographic unit cell.

Two new isomeric zinc(II) metal–organic frameworks based on 1,5-bis(2-methyl-1H-imidazol-1-yl)pentane and 5-methylisophthalate ligands

2017 ◽  
Vol 73 (2) ◽  
pp. 78-83
Author(s):  
Xiong-Wen Tan ◽  
Heng-Feng Li ◽  
Chang-Hong Li
Keyword(s):  
Self Assembly ◽  
Metal Organic Frameworks ◽  
Three Dimensional ◽  
Central Metal Atom ◽  
Central Metal ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Mixed Ligands ◽  
Metal Organic

Many factors, such as temperature, solvent, the central metal atom and the type of coligands, may affect the nature of metal–organic frameworks (MOFs) and the framework formation in the self-assembly process, which results in the complexity of these compounds and the uncertainty of their structures. Two new isomeric ZnIImetal–organic frameworks (MOFs) based on mixed ligands, namely, poly[[μ-1,5-bis(2-methyl-1H-imidazol-1-yl)pentane-κ2N3:N3′](μ-5-methylisophthalato-κ2O1:O3)zinc(II)], [Zn(C9H6O4)(C13H20N4)]n, (I), and poly[[μ-1,5-bis(2-methyl-1H-imidazol-1-yl)pentane-κ2N3:N3′](μ3-5-methylisophthalato-κ3O1:O1′:O3)(μ3-5-methylisophthalato-κ4O1:O1′:O3,O3′)dizinc(II)], [Zn2(C9H6O4)2(C13H20N4)]n, (II), have been synthesized under hydrothermal conditions and characterized by single-crystal X-ray diffraction, IR spectroscopy, elemental analysis and thermogravimetric analysis. Complex (I) displays a two-dimensional layer net, while complex (II) exhibits a twofold interpenetrating three-dimensional framework. Both complexes show high stability and good fluorescence in the solid state at room temperature.

A three-dimensional twofold interpenetrated cobalt(II) MOF containing a flexible carboxylate-based ligand: synthesis, structure and magnetic properties

2018 ◽  
Vol 74 (4) ◽  
pp. 418-423 ◽  
Author(s):  
Yan-Yan An ◽  
Li-Ping Lu ◽  
Miao-Li Zhu
Keyword(s):  
Self Assembly ◽  
Three Dimensional ◽  
Antiferromagnetic Coupling ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Design And Synthesis ◽  
Metal Organic ◽  
Cluster Representation ◽  
Methyl Benzene

The design and synthesis of coordination polymers (CPs) have attracted much interest due to the intriguing diversity of their architectures and topologies. The functional solid catena-poly[μ2-aqua-triaqua{μ4-5-[4-carboxyphenoxy)methyl]benzene-1,3-dicarboxylato}{μ3-5-[4-carboxyphenoxy)methyl]benzene-1,3-dicarboxylato}dicobalt(II)], [Co2(C16H10O7)2(H2O)4] n or [Co2(HL)2(μ2-H2O)(H2O)3] n , was synthesized successfully by self-assembly of CoII ions with 5-[(4-carboxyphenoxy)methyl]isophthalic acid (H3 L). The title compound was obtained under hydrothermal conditions and exhibits a twofold interpenetrated three-dimensional skeleton with hms 3,5-conn topology according to the cluster representation for valence-bonded metal–organic frameworks (MOFs). It has been characterized by single-crystal X-ray diffraction, IR spectroscopy, powder X-ray diffraction (PXRD), thermogravimetric analysis and susceptibility measurements. The antiferromagnetic coupling between adjacent CoII centres occurs via superexchange through the ligands.

Synthesis, structure and photoluminescence properties of a three-dimensional cadmium(II) (4,5)-connected coordination network

2018 ◽  
Vol 74 (12) ◽  
pp. 1581-1585 ◽  
Author(s):  
Ni-Ya Li ◽  
Dong Liu
Keyword(s):  
Crystal Engineering ◽  
Self Assembly ◽  
Title Compound ◽  
Three Dimensional ◽  
Functional Materials ◽  
Photoluminescence Properties ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
Coordination Network ◽  
Potential Applications

The assembly of coordination polymers from metal ions and organic moieties is currently attracting considerable attention in crystal engineering due to their intriguing architectures and potential applications as functional materials. A new coordination polymer, namely poly[[μ2-trans-1,2-bis(pyridin-3-yl)ethylene-κ2 N:N′]bis(μ4-4,4′-oxydibenzoato-κ6 O:O,O′:O′′:O′′,O′′′)dicadmium(II)], [Cd2(C14H8O5)2(C12H10N2)] n or [Cd2(4,4′-OBB)2(3,3′-BPE)] n , has been synthesized by the the self-assembly of Cd(NO3)2·4H2O, 4,4′-oxydibenzoic acid (4,4′-H2OBB) and trans-1,2-bis(pyridin-3-yl)ethene (3,3′-BPE) under hydrothermal conditions. The title compound was structurally characterized by IR spectroscopy, elemental analysis and single-crystal X-ray diffraction analysis. Each CdII centre is coordinated by six carboxylate O atoms from four different 4,4′-OBB2− ligands and by one pyridyl N atom form a 3,3′-BPE ligand. Adjacent crystallographically equivalent CdII ions are bridged by 4,4′-OBB2− ligands, affording a two-dimensional [Cd(4,4′-OBB)] n net extending in the ac plane. Neighbouring [Cd(4,4′-OBB)] n nets are interlinked by 3,3′-BPE along the b axis to form a three-dimensional (3D) [Cd2(4,4′-OBB)2(3,3′-BPE)] n coordination network. In the network, each CdII centre is linked by four different 4,4′-OBB2− ligands and one 3,3′-BPE ligand. Meanwhile, each 4,4′-OBB2− ligand connects four separate CdII ions. Therefore, if the 4,4′-OBB2− ligands and CdII ions are considered as 4- and 5-connecting nodes, the structure of the title compound can be simplified as a 3D (4,5)-connected binodal framework with the rare (4462)(4466) TCS topology (Pearson, 1985; Blake et al., 2011). The thermal stability and photoluminescence properties of the title compound have also been investigated.

A three-dimensional supramolecular framework based on the interlinkage of an interpenetrating diamondoid coordination network

2017 ◽  
Vol 73 (11) ◽  
pp. 869-873 ◽  
Author(s):  
Yi-Xuan Hou ◽  
Dong Liu
Keyword(s):  
Self Assembly ◽  
Three Dimensional ◽  
Water Molecules ◽  
Supramolecular Framework ◽  
X Ray Diffraction ◽  
Interpenetrating Networks ◽  
Hydrothermal Conditions ◽  
Dioic Acid ◽  
X Ray ◽  
Coordinated Water

In the development of coordination-driven crystalline materials, O- and N-atom donors from carboxylate and pyridyl-based ligands are widely used classes of multidentate bridging ligands composed of several terminal coordinating groups linked by either rigid or flexible spacers. The rigidity of the ligands can play a vital role in the determination of the structures formed. A new CdII supramolecular compound, namely poly[μ-adipato-κ2 O 1:O 4-μ-adipato-κ4 O 1,O 1′:O 4,O 4′-diaquabis[μ-1,4-bis(pyridin-4-yl)-1,3-butadiene-κ2 N:N′]dicadmium(II)], [Cd2(C6H8O4)2(C14H12N2)2(H2O)2] n , (I), has been synthesized by the self-assembly of Cd(NO3)2·4H2O, adipic acid (hexane-1,6-dioic acid; H2adp) and the dipyridyl ligand 1,4-bis(pyridin-4-yl)buta-1,3-diene (1,4-bpbd) under hydrothermal conditions. Single-crystal X-ray diffraction analysis reveals that each CdII centre is located in a distorted octahedral coordination environment, coordinated by one water O atom, three carboxylate O atoms from two different adp2− ligands and two N atoms from two different 1,4-bpbd ligands. The Cd(H2O) units are interconnected by the μ2,κ2-adp2−, μ2,κ4-adp2− and 1,4-bpbd ligands, which lie across centres of inversion, to give a 66-dia network. Large cavities within a single diamondoid network permit the mutual threefold interpenetration of crystallographically equivalent frameworks. Hydrogen-bonding interactions between the coordinated water molecules and adp2− carboxylate O atoms anchor the interpenetrating networks into a unique three-dimensional supramolecular structure. Topologically, taking the coordinated water molecules and CdII centres as nodes, the whole architecture can be simplified as a binodal (3,7)-connected supramolecular framework. The identity of (I) was further characterized by IR spectroscopy, elemental analysis, thermogravimetric analysis and powder X-ray diffraction. The solid-state photoluminescence properties of (I) were also investigated.

scholarly journals An investigation of polyhedral deformation in two mixed-metal diarsenates: SrZnAs2O7and BaCuAs2O7

2015 ◽  
Vol 71 (4) ◽  
pp. 330-337 ◽  
Author(s):  
Sabina Kovač ◽  
Ljiljana Karanović ◽  
Tamara Đorđević
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
General Formula ◽  
Three Dimensional ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Open Framework ◽  
Geometrical Characteristics ◽  
Barium Copper

Two isostructural diarsenates, SrZnAs2O7(strontium zinc diarsenate), (I), and BaCuAs2O7[barium copper(II) diarsenate], (II), have been synthesized under hydrothermal conditions and characterized by single-crystal X-ray diffraction. The three-dimensional open-framework crystal structure consists of corner-sharingM2O5(M2 = Zn or Cu) square pyramids and diarsenate (As2O7) groups. Each As2O7group shares its five corners with five differentM2O5square pyramids. The resulting framework delimits two types of tunnels aligned parallel to the [010] and [100] directions where the large divalent nine-coordinatedM1 (M1 = Sr or Ba) cations are located. The geometrical characteristics of theM1O9,M2O5and As2O7groups of known isostructural diarsenates, adopting the general formulaM1IIM2IIAs2O7(M1II= Sr, Ba, Pb;M2II= Mg, Co, Cu, Zn) and crystallizing in the space groupP21/n, are presented and discussed.

Crystal structures of (S)- and (R,S)-2,2′-bipyridine-3,3′-dicarboxylic acid 1,1′-dioxides and of their barium salts: absolute configuration and molecular distortion enforced by supramolecular self-assembly

1997 ◽  
Vol 212 (3) ◽  
Author(s):  
P. Vojtíšek ◽  
I. Císařová ◽  
J. Podlaha ◽  
Z. Žák ◽  
S. Böhm ◽  
...  
Keyword(s):  
Single Crystal ◽  
Dicarboxylic Acid ◽  
Crystal Structures ◽  
Absolute Configuration ◽  
Self Assembly ◽  
Barium Salt ◽  
X Ray Diffraction ◽  
X Ray

AbstractCrystal structures of the title compounds were determined by single crystal X-ray diffraction. Absolute configuration of the barium salt of (+)-(

Hydrothermal Syntheses, Crystal Structures, and Luminescent Properties of Two MnII Coordination Polymers: From Two-Fold Interpenetrated pcu Topological Net to Polycatenated 2D+2D→3D Framework

2015 ◽  
Vol 68 (2) ◽  
pp. 322 ◽  
Author(s):  
Wenlong Liu ◽  
Mengqiang Wu ◽  
Xueying Wang ◽  
Wei Wang ◽  
Dayu Liu ◽  
...  
Keyword(s):  
Dicarboxylic Acid ◽  
Coordination Polymers ◽  
Self Assembly ◽  
Room Temperature ◽  
Luminescent Properties ◽  
The Self ◽  
X Ray Diffraction ◽  
X Ray ◽  
3D Framework ◽  
Dimethyl Benzene

Using a hydrothermal synthesis, the self-assembly of MnII ions and 1,4-bis(1-imidazol-yl)-2,5-dimethyl benzene with two dicarboxylate ligands, 2-nitrobenzene-1,4-dicarboxylic acid (2-H2ata) and 5-methylbenzene-1,3-dicarboxylic acid (5-CH3-H2ip) constructed two interesting coordination polymers: [Mn(2-ata)(bimb)]n (1) and {[Mn(5-CH3-ip)(bimb)1.5]·2H2O}n (2), where bimb refers to 1,4-bis(1-imidazol-yl)-2,5-dimethyl benzene. Their structures were determined by single-crystal X-ray diffraction, elemental analysis, and infrared spectroscopy. Complex 1 exhibits a 2-fold interpenetrated pcu net. Complex 2 shows an unusual polycatenated 2D+2D→3D framework. In addition, the solid-state photoluminescent properties of 1 and 2 were investigated at room temperature.

Metal Ion-Driven Assembly of Two New Coordination Polymers Constructed by Asymmetric Tricarboxylate and Imidazole-Containing Ligands: Syntheses, Crystal Structures, and Luminescent Properties

2015 ◽  
Vol 68 (1) ◽  
pp. 121 ◽  
Author(s):  
Wenlong Liu ◽  
Xueying Wang ◽  
Mengqiang Wu ◽  
Bing Wang
Keyword(s):  
Infrared Spectroscopy ◽  
Coordination Polymers ◽  
Metal Ion ◽  
Three Dimensional ◽  
Luminescent Properties ◽  
Dimensional Structure ◽  
X Ray Diffraction ◽  
Hydrothermal Conditions ◽  
X Ray ◽  
Dimethyl Benzene

Two new coordination polymers, namely, {[Cd3(bpt)2(bimb)2]·2(H2O)}n (1) and [Zn3(bpt)2(bimb)2]n (2) (bpt = biphenyl-3,4′,5-tricarboxylate, bimb = 1,4-bis(1-imidazol-yl)-2,5-dimethyl benzene), have been obtained under hydrothermal conditions. Their structures have been determined by single-crystal X-ray diffraction analysis and further characterised by elemental analysis and infrared spectroscopy. Complex 1 exhibits a trinodal (4,4,4)-connected topology with Schläfli symbol of (4.62.83)4.(64.82). Complex 2 is also a three-dimensional structure and displays a (3,4,6)-connected topology with Schläfli symbol of (4.62)2.(42.66.85.102).(64.82). It is shown that the asymmetrically tricarboxylate can bear diverse structures regulated by metal ions. The photoluminescence behaviours of compounds 1 and 2 were also discussed.

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