2,2′-[m-Phenylenebis(methyleneimino)]dipyridinium dichloridobis(4-formylbenzoato-κ2 O,O′)cadmate(II) dihydrate

2007 ◽  
Vol 63 (11) ◽  
pp. m2834-m2834
Author(s):  
Zhao-Peng Deng ◽  
Shan Gao ◽  
Li-Hua Huo ◽  
Hui Zhao
Keyword(s):  
Rotation Axis ◽  
Chain Structure ◽  
Octahedral Geometry ◽  
Water Molecules ◽  
Carboxylate Group ◽  
Cl Atoms ◽  
Hydrogen Bonded

The CdII atom in the title salt, (C18H20N4)[CdCl2(C8H5O3)2]·2H2O, lies on a twofold rotation axis. It is chelated by the carboxylate group and exists in an octahedral geometry, with the Cl atoms cis to each other. The dication also lies on a twofold rotation axis. The cation and anion interact through one of the uncoordinated water molecules, forming a hydrogen-bonded chain structure that runs along the a axis.

scholarly journals 2-Amino-5-chloropyridinium cis-diaquadioxalatochromate(III) sesquihydrate

2012 ◽  
Vol 68 (6) ◽  
pp. m824-m825 ◽  
Author(s):  
Ichraf Chérif ◽  
Jawher Abdelhak ◽  
Mohamed Faouzi Zid ◽  
Ahmed Driss
Keyword(s):  
Rotation Axis ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Lattice Water ◽  
Compound C ◽  
Hydrogen Bonding Interactions ◽  
Distorted Octahedral ◽  
Independent Lattice

In the crystal structure of the title compound, (C5H6ClN2)[Cr(C2O4)2(H2O)2]·1.5H2O, the CrIII atom adopts a distorted octahedral geometry being coordinated by two O atoms of two cis water molecules and four O atoms from two chelating oxalate dianions. The cis-diaquadioxalatochromate(III) anions, 2-amino-5-chloropyridinium cations and uncoordinated water molecules are linked into a three-dimensional supramolecular array by O—H...O and N—H...O hydrogen-bonding interactions. One of the two independent lattice water molecules is situated on a twofold rotation axis.

scholarly journals Crystal structure ofcatena-poly[[diaquabis(4-formylbenzoato-κO1)cobalt(II)]-μ-pyrazine-κ2N:N′]

2015 ◽  
Vol 71 (4) ◽  
pp. 339-341 ◽  
Author(s):  
Gülçin Şefiye Aşkın ◽  
Fatih Çelik ◽  
Nefise Dilek ◽  
Hacali Necefoğlu ◽  
Tuncer Hökelek
Keyword(s):  
Hydrogen Bonds ◽  
Rotation Axis ◽  
Three Dimensional ◽  
Water Molecules ◽  
Carboxylate Group ◽  
Polymeric Compound ◽  
Distorted Octahedral Coordination ◽  
Linear Chains ◽  
Dimensional Network ◽  
Distorted Octahedral

In the title polymeric compound, [Co(C8H5O3)2(C4H4N2)(H2O)2]n, the CoIIatom is located on a twofold rotation axis and has a slightly distorted octahedral coordination sphere. In the equatorial plane, it is coordinated by two carboxylate O atoms of two symmetry-related monodentate formylbenzoate anions and by two N atoms of two bridging pyrazine ligands. The latter are bisected by the twofold rotation axis. The axial positions are occupied by two O atoms of the coordinating water molecules. In the formylbenzoate anion, the carboxylate group is twisted away from the attached benzene ring by 7.50 (8)°, while the benzene and pyrazine rings are oriented at a dihedral angle of 64.90 (4)°. The pyrazine ligands bridge the CoIIcations, forming linear chains running along theb-axis direction. Strong intramolecular O—H...O hydrogen bonds link the water molecules to the carboxylate O atoms. In the crystal, weak O—Hwater...Owaterhydrogen bonds link adjacent chains into layers parallel to thebcplane. The layers are linkedviaC—Hpyrazine...Oformylhydrogen bonds, forming a three-dimensional network. There are also weak C—H...π interactions present.

scholarly journals Crystal structure of a polymeric calcium levulinate dihydrate:catena-poly[[diaquacalcium]-bis(μ2-4-oxobutanoato)]

2015 ◽  
Vol 71 (5) ◽  
pp. 494-497
Author(s):  
Ananda S. Amarasekara ◽  
Dominique T. Sterling-Wells ◽  
Carlos Ordonez ◽  
Marie-Josiane Ohoueu ◽  
Marina S. Fonari
Keyword(s):  
Hydrogen Bonds ◽  
Rotation Axis ◽  
Three Dimensional ◽  
Axial Direction ◽  
Chain Structure ◽  
Dimensional Structure ◽  
Polymeric Chain ◽  
Water Molecules ◽  
Carboxylate Ligands ◽  
Length Range

In the title calcium levulinate complex, [Ca(C5H7O3)2(H2O)2]n, the Ca2+ion lies on a twofold rotation axis and is octacoordinated by two aqua ligands and six O atoms from four symmetry-related carboxylate ligands, giving a distorted square-antiprismatic coordination stereochemistry [Ca—O bond-length range = 2.355 (1)–2.599 (1) Å]. The levulinate ligands act both in a bidentate carboxylO,O′-chelate mode and in a bridging mode through one carboxyl O atom with an inversion-related Ca2+atom, giving a Ca...Ca separation of 4.0326 (7) Å. A coordination polymeric chain structure is generated, extending along thec-axial direction. The coordinating water molecules act as double donors and participate in intra-chain O—H...O hydrogen bonds with carboxyl O atoms, and in inter-chain O—H...O hydrogen bonds with carbonyl O atoms, thus forming an overall three-dimensional structure.

scholarly journals Poly[[tetra-μ-cyanido-κ8C:N-dodeca-cyanido-κ12C-tris(N,N-dimethylformamide-κO)tris(methanol-κO)tris(3,4,7,8-tetramethyl-1,10-phenanthroline-κ2N,N′)trimanganese(II)ditungstate(V)] dihydrate]

2014 ◽  
Vol 70 (5) ◽  
pp. m170-m171
Author(s):  
Fei-Lin Yang ◽  
Dan Yang
Keyword(s):  
Water Molecule ◽  
Title Compound ◽  
Chain Structure ◽  
Octahedral Geometry ◽  
The Other ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Asymmetric Unit ◽  
Π Interactions ◽  
Distorted Octahedral

The asymmetric unit of the title compound, {[Mn3{W(CN)8}2(C16H16N2)3(C3H7NO)3(CH3OH)3]·2H2O}n, consists of three [Mn(N,N-dimethylformamide)(methanol)(3,4,7,8-tetramethyl-1,10-phenanthroline)]2+cations, two [W(CN)8]3−anions and two water molecules. Each water molecule is disordered over three sets of sites, with a refined occupancy ratio of 0.310 (9):0.275 (9):0.415 (9) for one molecule and 0.335 (9):0.288 (9):0.377 (9) for the other molecule. The MnIIatoms exhibit a distorted octahedral geometry, while the WVatoms adopt a distorted square-antiprismatic geometry. The MnIIand WVatoms are linked alternatively through cyanide groups, forming a tetranuclear 12-atom rhombic metallacycle. Adjacent metallacycles are further connected by μ2-bridging cyanide anions, generating a 3,2-chain structure running parallel to [101]. Interchain π–π interactions are observed [centroid–centroid distances = 3.763 (3) and 3.620 (2) Å].

scholarly journals cis-Tetraaquabis{5-[4-(1H-imidazol-1-yl-κN3)phenyl]tetrazolido}manganese(II) dihydrate

2012 ◽  
Vol 68 (4) ◽  
pp. m413-m414 ◽  
Author(s):  
Xin Wang ◽  
Shi-Wei Yan ◽  
Suo-Cheng Chang ◽  
Yan-Chen Liang ◽  
Fu-Tian Zhang
Keyword(s):  
Hydrogen Bonds ◽  
Rotation Axis ◽  
Three Dimensional ◽  
Imidazole Ring ◽  
Octahedral Geometry ◽  
Dimensional Structure ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Solvent Water ◽  
Distorted Octahedral

In the title compound, [Mn(C10H7N6)2(H2O)4]·2H2O, the complex unit comprises an Mn2+ion, coordinated by two imidazole N atoms fromcis-related monodentate 5-[4-(imidazol-1-yl)phenyl]tetrazolide ligands and four water molecules, together with two water molecules of solvation. The Mn2+ion lies on a twofold rotation axis and has a slightly distorted octahedral geometry. The molecules are connected by O—H...N and O—H...O hydrogen bonds involving both coordinated and solvent water molecules, generating a three-dimensional structure. Two C atoms of the imidazole ring of the ligand are each disordered over two sites with occupancy factors of 0.75 and 0.25.

scholarly journals Poly[[μ-chlorido-μ-[2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol-κ2N4:N4′]-zinc] chloride dihydrate]

2013 ◽  
Vol 69 (11) ◽  
pp. m573-m573 ◽  
Author(s):  
Gang-Hong Pan ◽  
Jin-Niu Tang ◽  
Shi-Hua Xu ◽  
Zhong-Jing Huang ◽  
Bo-Fa Mo
Keyword(s):  
Octahedral Geometry ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Chloride Dihydrate ◽  
Lattice Water ◽  
Free Chloride ◽  
Centroid Distance ◽  
Distorted Octahedral ◽  
Dinuclear Unit ◽  
Cl Atoms

The title compound, {[ZnCl(C13H12F2N6O)2]Cl·2H2O}n, is a two-dimensional coordination polymer. The ZnIIatom is six-coordinated by four N atoms from four 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol (HFlu) ligands and by two Cl atoms in a distorted octahedral geometry. Two Cl atoms bridge two ZnIIatoms, forming a centrosymmetric dinuclear unit. The HFlu ligands connect the dinuclear units into a 44net parallel to (001) when the dinuclear unit is considered as a node. O—H...O and O—H...Cl hydrogen bonds link the cationic layer, free chloride anions and lattice water molecules. Intralayer π–π interactions between the triazole rings are observed [centroid–centroid distance = 3.716 (6) Å].

scholarly journals Hydrogen-bonded two- and three-dimensional polymeric structures in the ammonium salts of 3,5-dinitrobenzoic acid, 4-nitrobenzoic acid and 2,4-dichlorobenzoic acid

2014 ◽  
Vol 70 (3) ◽  
pp. 315-319 ◽  
Author(s):  
Graham Smith
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Ammonium Salts ◽  
Dimensional Structure ◽  
Water Molecules ◽  
Carboxylate Group ◽  
Two Dimensional ◽  
Structure Extension ◽  
Polymeric Structures ◽  
Hydrogen Bonded

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.

scholarly journals Diaquabis{1-[(1H-benzimidazol-2-yl)methyl]-1H-imidazole-κN 3}dichloridocadmium hexahydrate

2012 ◽  
Vol 68 (6) ◽  
pp. m754-m754
Author(s):  
Xin-Nian Xie ◽  
Meng Lu ◽  
Juan Yuan ◽  
Huai-Xia Yang
Keyword(s):  
Rotation Axis ◽  
Three Dimensional ◽  
Water Molecules ◽  
Complex Molecules ◽  
Rotation Axes ◽  
Octahedral Environment ◽  
Dimensional Network ◽  
Crystal Complex ◽  
Cl Atoms ◽  
Imidazole Ligands

In the title complex, [CdCl2(C11H10N4)2(H2O)2]·6H2O, the CdII atom is located on a twofold rotation axis and is coordinated by two N atoms from two 1-[(1H-benzimidazol-2-yl)methyl]-1H-imidazole ligands and two water O atoms in equatorial positions and by two Cl atoms in axial positions, leading to an elongated octahedral environment. The two coordinating and two of the lattice water molecules are also located on twofold rotation axes. In the crystal, complex molecules and solvent water molecules are linked through a complex intermolecular N—H...O, O—H...N, O—H...O and O—H...Cl hydrogen-bonding scheme into a three-dimensional network.

Pentaaqua(pyridine-3,5-dicarboxylato-κN)nickel(II) dihydrate

2006 ◽  
Vol 62 (4) ◽  
pp. m791-m792 ◽  
Author(s):  
Xiang-Pei Zhang ◽  
Guang Yang ◽  
Seik Weng Ng
Keyword(s):  
Title Compound ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Water Molecules ◽  
Complex Molecules ◽  
Coordinated Water ◽  
Hydrogen Bonded

In the title compound, [Ni(C7H3NO4)(H2O)5]·2H2O, the pyridine-3,5-dicarboxylate dianion bonds through its N atom to Ni, the octahedral geometry of the latter being completed by five water molecules. Adjacent complex molecules are linked through the two non-coordinated water molecules, forming a three-dimensional, tightly held, hydrogen-bonded network.

scholarly journals Dichloridotetrakis(1H-1,2,4-triazole-κN4)copper(II)

2012 ◽  
Vol 68 (4) ◽  
pp. m375-m376 ◽  
Author(s):  
Maja Vidmar ◽  
Tatjana Kobal ◽  
Bojan Kozlevčar ◽  
Primož Šegedin ◽  
Amalija Golobič
Keyword(s):  
Hydrogen Bonds ◽  
Equatorial Plane ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Title Complex ◽  
Twofold Axis ◽  
A Site ◽  
Cl Atoms ◽  
Hydrogen Bonded

The central CuIIatom of the molecular title complex, [CuCl2(C2H3N3)4], is situated on a site with symmetry 2.22. It is six-coordinated in an elongated octahedral geometry, with the equatorial plane defined by four N atoms of four 1,2,4-triazole ligands and the axial positions occupied by two Cl atoms situated on a twofold axis. The molecules are connectedviaN—H...Cl hydrogen bonds and the crystal consists of two interpenetrating three-dimensional hydrogen-bonded frameworks.

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