A two-dimensional hydrogen-bonded water layer in the structure of a cobalt(III) cubane complex

2014 ◽  
Vol 70 (2) ◽  
pp. 198-201 ◽  
Author(s):  
Ji Qi ◽  
Xiang-Sheng Zhai ◽  
Hong-Lin Zhu ◽  
Jian-Li Lin

A tetranuclear CoIIIoxide complex with cubane topology, tetrakis(2,2′-bipyridine-κ2N,N′)di-μ2-carbonato-κ4O:O′-tetra-μ3-oxido-tetracobalt(III) pentadecahydrate, [Co4(CO3)2O4(C10H8N2)4]·15H2O, with an unbounded hydrogen-bonded water layer, has been synthesized by reaction of CoCO3and 2,2′-bipyridine. The solvent water molecules form a hydrogen-bonded net with tetrameric and pentameric water clusters as subunits. The Co4O4cubane-like cores are sandwiched between the water layers, which are further stacked into a three-dimensional metallo-supramolecular network.

2014 ◽  
Vol 70 (11) ◽  
pp. 1083-1087 ◽  
Author(s):  
Hou-Ting Liu ◽  
Jing Lu

A new CuII–azide complex, {(C4H12N2)[Cu5(N3)12]·4H2O}n, has been synthesized by the reaction of piperazine, Cu(OAc)2·2H2O (OAc is acetate) and NaN3. In the structure, μ2-1,1- and μ3-1,1,1-azide anions bridge five CuIIcations to form a linear pentanuclear cluster unit, which is further linked by μ2-1,1- and μ2-1,3-azide anions to form a two-dimensional condensed [Cu5(N3)12]nlayer. The diprotonated piperazine and the solvent water molecules are hydrogen bonded to the coordination layers to form a three-dimensional supramolecular network.


2014 ◽  
Vol 70 (3) ◽  
pp. 315-319 ◽  
Author(s):  
Graham Smith

The structures of ammonium 3,5-dinitrobenzoate, NH4+·C7H3N2O6−, (I), ammonium 4-nitrobenzoate dihydrate, NH4+·C7H4NO4−·2H2O, (II), and ammonium 2,4-dichlorobenzoate hemihydrate, NH4+·C7H3Cl2O2−·0.5H2O, (III), have been determined and their hydrogen-bonded structures are described. All three salts form hydrogen-bonded polymeric structures,viz.three-dimensional in (I) and two-dimensional in (II) and (III). With (I), a primary cation–anion cyclic association is formed [graph setR43(10)] through N—H...O hydrogen bonds, involving a carboxylate group with both O atoms contributing to the hydrogen bonds (denoted O,O′-carboxylate) on one side and a carboxylate group with one O atom involved in two hydrogen bonds (denoted O-carboxylate) on the other. Structure extension involves N—H...O hydrogen bonds to both carboxylate and nitro O-atom acceptors. With structure (II), the primary inter-species interactions and structure extension into layers lying parallel to (001) are through conjoined cyclic hydrogen-bonding motifs,viz.R43(10) (one cation, an O,O′-carboxylate group and two water molecules) and centrosymmetricR42(8) (two cations and two water molecules). The structure of (III) also has conjoinedR43(10) and centrosymmetricR42(8) motifs in the layered structure but these differ in that the first motif involves one cation, an O,O′-carboxylate group, an O-carboxylate group and one water molecule, and the second motif involves two cations and two O-carboxylate groups. The layers lie parallel to (100). The structures of salt hydrates (II) and (III), displaying two-dimensional layered arrays through conjoined hydrogen-bonded nets, provide further illustration of a previously indicated trend among ammonium salts of carboxylic acids, but the anhydrous three-dimensional structure of (I) is inconsistent with that trend.


2007 ◽  
Vol 63 (11) ◽  
pp. m2818-m2818
Author(s):  
Zhao-Peng Deng ◽  
Shan Gao ◽  
Li-Hua Huo ◽  
Hui Zhao

The title complex, [Cd(C8H5O3)2(H2O)3]·3H2O, is a neutral mononuclear molecule consisting of a CdII atom chelated by two 4-formylbenzoate ligands and coordinated by three water molecules in a pentagonal–bipyramidal geometry. A three-dimensional hydrogen-bonded supramolecular network is formed by intermolecular hydrogen bonds.


2003 ◽  
Vol 59 (2) ◽  
pp. 248-262 ◽  
Author(s):  
Katharine F. Bowes ◽  
George Ferguson ◽  
Alan J. Lough ◽  
Christopher Glidewell

The structures of seven salts formed by phosphonopropionic acid with organic diamines are reported; in these salts, the hydrogen-bonded substructures formed by the anions can be zero-, one- or two-dimensional, while the overall hydrogen-bonded supramolecular structures are three-dimensional. The 1:1 adduct, compound (1), formed between 1,2-bis(4′-pyridyl)ethene and phosphonopropionic acid is a salt, [{(C12H10N2)H2}2+]·[(C12H10N2)]·[(C3H6O5P)−]2, in which both diamine components lie across centres of inversion in space group P21/c. The anions form hydrogen-bonded head-to-head dimers, and these are linked by the two diamine units into sheets, which are themselves linked by C—H...O hydrogen bonds. With 2,2′-dipyridylamine the acid forms the hydrated salt [{(C10H9N3)H}+]·[(C3H6O5P)−]·H2O (2), in which all components are disordered with occupancy 0.5 in space group Fmm2. The anions form head-to-tail dimers, which are linked into sheets by the cations, and the sheets are linked into a three-dimensional framework by the water molecules. The piperazine salt [{(C4H10N2)H2}2+]·[(C3H5O5P)2−] (3) contains simple anion chains linked into a three-dimensional framework by the two independent cations, both of which are centrosymmetric. In the hydrated salt formed by N,N′-dimethylpiperazine, [{(MeNC4H8NMe)H2}2+]·[(C3H6O5P)−]2·(H2O)2 (4), head-to-tail anion chains combine with the water molecules to form a three-dimensional framework, which encloses voids that contain the cations. In the 4,4′-bipyridyl adduct [{(C10H8N2)H0.72}0.72+]·[{(H0.5O)3PCH2CH2COOH0.78}0.72−] (5), there is extensive disorder of the H atoms that are bonded to N and O atoms, and the anion chains are linked by the cations into sheets, which are themselves linked by C—H...O hydrogen bonds. In the 1:2 adduct formed with 1,2-bis(4′-pyridyl)ethane, [{(C12H12N2)H2}2+]·[(C3H6O5P)−]2 (6), where the cation lies across an inversion centre, the anions form molecular ladders. These ladders are linked into sheets by the cations, which are themselves linked by C—H...O hydrogen bonds. In the methanol-solvated salt formed with 2,6-dimethylpiperazine, [{(C6H14N2)H2}2+]·[(C3H6O5P)−]2· (CH4O)0.34 (7), the anions form sheets that are linked into a three-dimensional framework by the cations. The supramolecular structures are compared with those of analogous salts formed by phosphonoacetic acid.


1996 ◽  
Vol 51 (4) ◽  
pp. 536-544 ◽  
Author(s):  
Thomas Dahlems ◽  
Dietrich Mootz ◽  
Michaela Schilling

Abstract Hydrate formation of haloacetic acids CClnF3-nCOOH (n = 1, 2, 3) has been studied by DTA and temperature-dependent X-ray powder diffraction, and evidence obtained for five phases, all melting at temperatures below ambient. The hydrates have been confirmed and further characterized by their crystal structures at -150 °C. Three lower hydrates, CCl2FCOOH· 0.5H2O (space group P21/c and Z = 8 formula unites per unit cell), CClF2COOHH2O (P21/c, Z = 4), and CClF2COOH ·4H2O (P1̄, Z = 2), have molecular structures with the acid and water molecules hydrogen-bonded in two-dimensional arrays. The structures of the remaining hydrates, CCl2FCOOH·6H2O and CCl3COOH · 6H2O (similar, but not isotypic, both P1̄ and Z = 2), are ionic, as (H5O2+)(CX3COO-) · 4H2O , and three-dimensional. The neutral water molecules are hydrogen-bonded in ice-like layers rare in crystal chemistry. Also, CCl2FCOOH is established only as the second acid of which a lower hydrate is molecular and a higher one ionic.


2018 ◽  
Vol 74 (4) ◽  
pp. 504-512
Author(s):  
Chang-Kai Su ◽  
Kou-Lin Zhang

Two new CoII coordination polymers (CPs), namely, catena-poly[[[(5-amino-2,4,6-tribromobenzene-1,3-dicarboxylato-κO)aquacobalt(II)]-bis[μ-1,3-bis(imidazol-1-ylmethyl)benzene-κ2 N:N′]] 4.75-hydrate], {[Co(C8H2Br3NO4)(C14H14N4)2(H2O)]·4.75H2O} n , (1), and poly[(μ-5-amino-2,4,6-tribromobenzene-1,3-dicarboxylato-κ2 O 1:O 3)[μ-1,2-bis(imidazol-1-ylmethyl)benzene-κ2 N:N′]cobalt(II)], [Co(C8H2Br3NO4)(C14H14N4)] n , (2), have been synthesized successfully by the assembly of multifunctional 5-amino-2,4,6-tribromoisophthalic acid (H2ATBIP) and CoII ions in the presence of the flexible isomeric bis(imidazole) ligands 1,3-bis(imidazol-1-ylmethyl)benzene (mbix) and 1,2-bis(imidazol-1-ylmethyl)benzene (obix). The isomeric mbix and obix ligands have a big influence on the structures of CPs (1) and (2). CP (1) is composed of chains of nanometre-sized elliptical rings, in which the CoII atom exhibits a distorted octahedral coordination geometry and ATBIP2− acts as a monodentate ligand. Two adjacent chains are interlinked by π–π stacking interactions and hydrogen bonds, resulting in a supramolecular double chain. Hydrogen-bonded R 8 6(16) rings extend adjacent supramolecular double chains into a two-dimensional supramolecular layer. Halogen bonding and a hydrogen-bonded R 4 2(8) ring further link the two-dimensional supramolecular layers, leading to the formation of a three-dimensional supramolecular network. The CoII ion in CP (2) is tetracoordinated, exhibiting a distorted tetrahedral configuration. The ATBIP2− ligand exhibits a bis(monodentate) coordination bridging mode, linking adjacent CoII ions into zigzag chains, which are further bridged by the auxiliary bridging obix ligand, resulting in a two-dimensional (4,4) topological network. Interlayer hydrogen and halogen–halogen bonding further extend the two-dimensional layers into a three-dimensional supramolecular network. A detailed analysis of the solid-state UV–Vis–NIR diffuse-reflectance spectra of (1) and (2) indicates that a wide optical band gap exists in both (1) and (2). CP (1) exhibits an irreversible dehydration–rehydration behaviour.


2014 ◽  
Vol 70 (2) ◽  
pp. 189-193 ◽  
Author(s):  
Kai-Long Zhong

In the ZnIIcompound poly[[bis(μ3-cyclohexane-1,3,5-tricarboxylato)bis[μ3-1,3,5-tris(imidazol-1-ylmethyl)benzene]trizinc(II)] hexahydrate], {[Zn3(C18H18N6)2(C9H9O6)2]·6H2O}n, based on mixed 1,3,5-tris(imidazol-1-ylmethyl)benzene and cyclohexane-1,3,5-tricarboxylate ligands, there are two types of crystallographically independent ZnIIcentres, one in a general position and one on a crystallographic twofold axis. They have similar fourfold distorted tetrahedral coordination geometries, ligated by two monodentate carboxylate groups from two cyclohexane-1,3,5-tricarboxylate ligands and by two N atoms from two 1,3,5-tris(imidazol-1-ylmethyl)benzene ligands. The cyclohexane-1,3,5-tricarboxylate anions link the ZnIIcations to generate a two-dimensional layered metal–organic structure running parallel to the (\overline{2}01) plane. Adjacent layers are further connected by tripodal 1,3,5-tris(imidazol-1-ylmethyl)benzene ligands, resulting in a three-dimensional network. The solvent water molecules are linked to the cyclohexane-1,3,5-tricarboxylate ligandsviawater–carboxylate O—H...O hydrogen bonds.


2013 ◽  
Vol 69 (12) ◽  
pp. 1545-1548 ◽  
Author(s):  
De-Hong Wu

The title compound, 3C6H4N4O2S2·2C3H7NO·4H2O, comprises three 2,2′-disulfanylidene-5,5′-biimidazolidinylidene-4,4′-dione molecules, two dimethylformamide molecules and four water molecules arranged around a crystallographic inversion centre. The non-H atoms within the 5,5′-biimidazolidinylidene molecule are coplanar and these molecules aggregate through N—H...S hydrogen-bonding interactions with cyclic motifs [graph setR22(8)], giving two-dimensional ribbon structures which are close to being parallel. The two independent water molecules associate to form centrosymmetric cyclic hydrogen-bonded (H2O)4tetrameric units [graph setR44(8)]. The ribbon structures extend along theaaxis and are linked through the water tetramers and the dimethylformamide molecules by a combination of two- and three-centre hydrogen bonds, giving an overall three-dimensional structure.


2006 ◽  
Vol 62 (7) ◽  
pp. o2797-o2799
Author(s):  
Zi-Lu Chen ◽  
Yu-Zhen Zhang ◽  
Fu-Pei Liang

The title compound, C2H10N2 2+·2Cl−·2C12H8N2·4H2O, has an inversion centre located midway between the two C atoms of the ethylenediammonium cation. The 1,10-phenanthroline molecules stack along the a axis, and are linked by π–π stacking interactions to form one-dimensional chains. These are bridged by ethylenediammonium cations, via hydrogen bonds, forming two-dimensional supramolecular sheets parallel to the ac plane. Hydrogen bonds to chloride anions and water molecules connect these two-dimensional sheets, resulting in the formation of a three-dimensional supramolecular network.


Author(s):  
Wei-Qiang Liao ◽  
Yi Zhang

The structure of the title compound,catena-poly[[cadmium(II)-di-μ-chlorido-μ-(1,4-diazoniabicyclo[2.2.2]octane-1-carboxylato)] [[aquachloridocadmium(II)]-di-μ-chlorido] dihydrate], {[Cd(C8H15N2O2)Cl2][CdCl3(H2O)]·2H2O}n, contains two kinds of independent one-dimensional chain,viz.{[Cd(C8H15N2O2)Cl2]+}nand {[CdCl3(H2O)]−}n, and uncoordinated water molecules. Each CdIIcation in the {[Cd(C8H15N2O2)Cl2]+}nchain is octahedrally coordinated by two pairs of bridging chloride ligands and two O atoms from different bridging carboxylate groups. CdIIcations in the {[CdCl3(H2O)]−}nchain are also octahedrally surrounded by four bridging chloride ligands, one terminal chloride ligand and one coordinated water molecule. Hydrogen bonds between solvent water molecules and these two independent chains generate a three-dimensional framework containing two-dimensional zigzag layers.<!?tpb=18pt>


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