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1.
The structure of three complexes of bivalent metals (cobalt, nickel, and cadmium) with anions of benzoic (HL 1) and 2-(acetylamino)-5-nitrobenzoic (HL 2) acids, namely, [Co21 (H2O)2(μ-C4H4N2)] n (I), [NiL2(H2O)5]L2 · 2H2O (II), and [Cd(μ-L 2)2(H2O)2] n · 2nH2O (III), is determined. In chainlike structure I, cobalt atoms are connected by bridging pyrazine molecules; structure II contains isolated complexes. In structure III, centrosymmetric (CdOCO)2 cycles and polymeric ribbons are formed due to the coordination of the carboxylate group of the L 2 ligand to two cadmium atoms.  相似文献   

2.

Abstract  

Three new macrocyclic nickel(II) supramolecules, {[Ni(L1)(Hmal)2]} n (1), {[Ni(L1)(Hdipic)2]·(H2O)2·DMF} n (2) and {[Ni(L1)(Hisoph)2]·2DMF} n (3) (L = 3,14-dimethyl-2,6,13,17-tetraazatricyclo [14,4,01.18,07.12]docosane, mal = maleate, dipic = 2,6-pyridinedicarboxylate, isoph = isophthalate), have been synthesized and characterized by analytical, spectroscopic and X-ray diffraction methods. The complexes 13 show that the central nickel(II) ions are coordinated axially by two monodentate carboxylate ligands, respectively. The structures of 13 extend their mononuclear structures to form 1D supramolecules through hydrogen bonds. In 3, each 1D chain interacts together to form a 2D layer through hydrogen bonds between the Hisoph ligands.  相似文献   

3.
Abstract  The reaction of the dithioether ligand, 2,3-bis(pyrimidine-2-thiomethyl)quinoxaline (L) with AgNO3, leads to the formation of a novel complex {[Ag5(L)2(NO3)4](NO3)(CHCl3)2}n 1, which has been characterized by single-crystal X-ray diffraction analysis: monoclinic, space group C2/c, with a = 34.741(7), b = 9.930(2), c = 17.004(4) ?, β = 106.497(6)° and V = 5625(2) ?3.Complex 1 consists of 2D {[Ag5(L)2(NO3)4]+}n cations, uncoordinated anions and CHCl3 solvent molecules. In 1, there exist three crystallographic independent AgI centers, which adopt different coordination geometries. There exist ππ stacking interactions in the complex and these weak interactions further stabilize the crystal structure in the solid state. The coordination feature of the ligand has been investigated by DFT calculations. Index Abstract  Synthesis and Structure of a Silver(I) Complex {[Ag5(L)2(NO3)4](NO3)(CHCl3)2}n [L = 2,3-bis(pyrimidine-2-thiomethyl)quinoxaline] Chao-Yan Zhang, Qian Gao, Ya-Bo Xie*, and Jian-Bo Feng The crystal structure of complex {[Ag5(L)2(NO3)4](NO3)(CHCl3)2}n (L = 2,3-bis(pyrimidine-2-thiomethyl)quinoxaline) consists of 2D {[Ag5(L)2(NO3)4]+}n cations, uncoordinated anions and CHCl3 solvent molecules. There exist three crystallographic independent AgI centers, which adopt different coordination geometries. The coordination feature of the ligand has been investigated by DFT calculations.   相似文献   

4.
Abstract The reaction of the organic ligand, 5,6-dicyano-2,3-di(2-pyridyl)pyrazine (L) with AgClO4, leads to the formation of a novel complex {[Ag(L)(CH3CN)](ClO4)}n 1, which has been characterized by elemental analysis, IR and single-crystal X-ray diffraction analysis (monoclinic system, space group P2(1)/n, with a = 11.290(4), b = 12.660(5), c = 15.202(6) ?, β = 90.141(6)°, V = 13371(2) ?3 and Z = 4). The crystal structure of complex consists of polymeric chains of {[Ag(L)(CH3CN)]+}n cations and anions. In the cation of 1, each Ag(I) center is coordinated to four N atoms from two symmetry-equivalent L ligands and a CH3CN molecule. The adjacent two Ag(I) ions are linked by L ligands which adopt N3-coordinated bridging mode to form a zig-zag chain. Index abstract Synthesis and Crystal Structure of a 1D Silver(I) Complex {[Ag (L)(CH3CN)](ClO4)}n [L = 5,6-dicyano-2,3-di(2-pyridyl)pyrazine] Qian Gao, Ya-Bo Xie*, Sha Chen, and Dao Wang The crystal structure of complex {[Ag(L)(CH3CN)](ClO4)}n (L = 5,6-dicyano-2,3-di(2-pyridyl)pyrazine) consists of polymeric chains of {[Ag(L)(CH3CN)]+}n cations and anions. Each Ag(I) center is coordinated to four N atoms from two symmetry-equivalent ligands and a CH3CN molecule. The adjacent two Ag(I) ions are linked by ligands which adopt N3-coordinated bridging mode to form a zig-zag chain.   相似文献   

5.

Abstract  

The synthesis and single-crystal structure of a Na-salt compound Na10[Co4(OH2)2(AsW9O34)2]·32H2O (1) was reported. Compound 1 crystallizes in triclinic system, space group P−1, with the lattice parameters: a = 11.6040(10) ?, b = 12.9361(13) ?, c = 17.396(2) ?, α = 97.4120(10)°, β = 106.8590(10)°, γ = 111.867(2)° and Z = 1. Compound 1 consists of a pure inorganic network based on tetra-sodium capped sandwich-type anionic clusters [Co4(OH2)2(AsW9O34)2]10− bridged through Na–OH2 subunits. The thermogravimetric and electrochemistry measurements had also been studied.  相似文献   

6.
Cs[VO2(NO3)2] (I), MoO2(NO3)2 (II), and Cs[MoO2(NO3)3] (III) complexes have been obtained by crystallization from nitric solutions and studied by single-crystal X-ray diffraction. Complexes I and II contain infinite zigzag chains of similar compositions, [VO2(NO3)2] and [MoO2(NO3)2], in which V and Mo atoms form, respectively, trigonal- and pentagonal-bipyramidal polyhedra. Each of these polyhedrons also contains one terminal and two bridge O atoms and two terminal NO3 groups which are monodentate and bidentate in complexes I and II, respectively. Complex III has an island structure and consists of Cs+ cations and [MoO2(NO3)3] anions, in which the Mo atom is surrounded by one bidentate NO3 group and two monodentate NO3 groups and two terminal O atoms in the cis-positions; oxygen atoms form a polyhedron in the form of distorted octahedron. According to the ab initio calculation of isolated MoO2(NO3)2 molecules in the gas phase and solution, the coordination environment of the Mo atom, similarly to the Cr(VI) atom in CrO2(NO3)2, is formed by two bidentate nitrate groups and two terminal O atoms (polyhedron- twisted trigonal prism).  相似文献   

7.
Two new complexes {[Pb(L1)(DMSO)2(H2O)]·DMF}n (1, L1 = 2,2′-dihydroxy-l,l′-dinaphthyl-3,3′-dicarboxylate) and {[Pb(L2)(DMS O)·DMSO}n (2, L2 = 2,2′-dimethoxy-l,l′-dinaphthyl-3,3′-dicarboxylate) have been synthesized under mild conditions and structurally characterized. Crystal structural analysis reveals that complex 1 adopts a 1D infinite chain structure which forms 2D sheet by hydrogen bonds interactions. Complex 2 possesses a 2D sheet structure, which was further assembled into a 3D supramolecular network through the π-π weak interactions. IR spectra indicates the carboxyl group coordinates with the Pb2+ ion. TGA shows that complex 2 is highly thermally stable up to 120°C.  相似文献   

8.
Structural features of 3d metal complexes with anions of 1-hydroxyethylidenediphosphonic acid (HEDP, H4 L), in which the M: HEDP ratios are equal to 1: 2, 1: 1, 3: 2, and 5: 2, are discussed. The Cu(II): HEDP = 1: 2 complexes are characterized by five types of structures: monomeric structures trans-[Cu(H4 ? n L)2(H2O)2]2 ? 2n , cis-[Cu(H4 ? n L)2(H2O)2]2 ? 2n , and [Cu(L)2]6?; the dimeric structure { [Cu(H2 L)(H2O)]22-H2 L)2}4? ; and the polymeric chain structure {[Cu(μ 2-H2 L)2]2?}. Six coordination modes exhibited by HEDP in the Cu(II) compounds are described.  相似文献   

9.
A potential boronate affinity chromatography ligando-boronobenzalmethoxyamine (IV) and its precursor [o-formylbenzeneboronic acid (III)] were synthesized and characterized by three-dimensional single-crystal X-ray diffractometry. Both compounds contained no bonding between the boron atoms and the oxygen atoms [O(3)] of the distinguishing functional group. In addition,11B NMR data confirmed the lack of any coordination between the boron and oxygen atoms in the boronic acid compoundsIII andIV and the catachol ester derivative (V) ofIV.o-Formylbenzeneboronic acid (III) crystallizes in space groupP21/n witha=3.883(1),b= 13.225(1),c=14.029(2) Å, =92.16(1)o, and four molecules per unit cell.o-Boronobenzalmethoxyamine (IV) crystallizes in space group Pcen witha=14.158(2),b=17.156(1),c=7.734(2)Å, and eight molecules per unit cell. Selected bond distances and angles are tabularized.  相似文献   

10.

Abstract  

Four new nickel(II) and cobalt(II) complexes of Schiff base ligands: [Ni(L)Cl2]·2H2O (I), [Ni(L)(H2O)2] (NO3)2 (II), [Ni(L)(H2O)2] (ClO4)2 (III), and [Co(L) (H2O)2] (NO3)2 (IV) (L = 1,3-[bis(pyridine-2-imino)]propane) have been synthesized. The four complexes have been fully characterized by elemental analysis, IR, absorption spectra, emission spectra, and single-crystal X-ray diffraction analysis. The binding of the four complexes to calf thymus DNA (CT DNA) has been investigated by absorption spectra and emission spectra. The results of the two methods indicate that the action mode of complex I with DNA is intercalative mainly, and the action mode of complexes II, III, IV with DNA cannot be concluded, it should be sustained by other experimental measurements.  相似文献   

11.
A new dithioether silver(I) complex, {[Ag(L)1.5]NO3} n (1) has been prepared by the reaction of AgNO3 with 1,3-bis(benzylthio)propane (L) in methanol/chloroform. The structure was characterized by single-crystal X-ray diffraction analysis: rhombohedral system, space group R –3c, with a =b = 15.651(7), c = 39.26(4) Å, V = 8328(1) Å3, and Z = 6. The crystal structure consists of [Ag(L)1.5]+ cations and NO3 anions. In 1, each silver(I) center is coordinated equivalently to three sulfur donors from three different ligands to give a trigonal-planar coordination geometry. Each L links two adjacent silver(I) centers in bis-monodentate bridging mode to form a 2D (6,3) network sheet. Furthermore, these 2D sheets are linked by the weak coordination interactions between nitrate ions and silver(I) atoms to form a 3D brick-wall framework.  相似文献   

12.
Double zirconium and 3d-transition metal phosphates of the compositions M 0.5Zr2(PO4)3[M = Mn (I), Co (II), Ni (III), Cu (IV), Zn (V)] have been synthesized and the types of their structures have been refined. Compounds I, II, III, IV, and V are all monoclinic (sp. gr. P21/n, Z = 4) and have the unit cell parameters a = 12.390(3), 12.389(3), 12.385(3), 12.389(3), 12.389(2) Å; b = 8.931(4), 8.928(3), 8.924(4), 8.925(4), 8.929(3) Å; c = 8.843(3), 8.840(2), 8.840(3), 8.841(3), 8.842(2) Å, β = 90.55(1), 90.54(1), 90.53(1), 90.53(1), 90.54(1)°; V = 978.5, 977.7, 977.0, 977.4, 978.1 Å3, respectively. All the structures have the {[Zr2(PO4)3]?}3-type frameworks. The crystallographic data for 3d-transition and alkali earth metal phosphates described by the general formula M 0.5Zr2(PO4)3 are compared.  相似文献   

13.

Abstract  

By using a pre-designed anionic precursor [TpFeIII(CN)3] (Tp = hydrotris(pyrazolyl)borate) as a structural building block, a new cyanide-bridged one-dimensional heterobimetallic coordination polymer, [(Tp)2Fe2III(CN)6Zn·2H2O] n (I) has been prepared and characterized by X-ray single crystal diffraction, M?ssbauer and magnetic experiments. Complex I crystallizes in the orthorhombic Ibam space group with a = 14.4094(8) ?, b = 18.3003(10) ?, c = 12.9855(7) ? and consists of rhombic chains, in which the [TpFeIII(CN)3] unit acts as a bridging bidentate ligand toward two Zn2+ atoms through two of its three cyanide groups.  相似文献   

14.

Abstract  

The reaction of Ho(NO3)3 with the bulky anthracene-9-carboxylic acid (HL) and 1,10-phenanthroline (phen) in the presence of 2,6-dimethylpyridine afforded a dinuclear HoIII complex [Ho2(L)6(phen)2] (1) (L = anthracene-9-carboxylate), which was characterized by elemental analysis and single-crystal X-ray diffraction analysis (triclinic system, space group Pī, with a = 12.4994(3), b = 13.3556(3), c = 14.9751(3) ?, α = 110.7630(1), β = 103.0680(1), γ = 106.8530(1)°, V = 2080.59(9) ?3, and Z = 1). Complex 1 has a centrosymmetric binuclear cage structure in which two HoIII atoms are both nine-coordinated and bridged by four bulky anthracnene-9-carboxylate (L) ligands with a non-bonding Ho∙∙∙Ho separation of 3.9076 (2) ?. The anthracene-9-carboxylate groups coordinate each HoIII atom in three different ways. The adjacent discrete dinuclear subunits are arranged into a one-dimensional (1D) chain along the [111] direction by intermolecular π···π stacking interactions, with the centroid–centroid separation of 3.724(2) ?.  相似文献   

15.

A series of heterotrimetallic manganese-lanthanide-sodium dimer metallacrowns has been synthesized and characterized by single-crystal X-ray analysis: {LnNa[12-MCMn(III)N(shi)-4]}2(iph)4, where LnIII?=?La (1), Ce (2), Pr (3), Nd (4), Sm (5), Eu (6), Gd (7), Tb (8), Dy (9), Ho (10), Er (11), Tm (12), Yb (13), Lu (14), and Y (15); MC is metallacrown; shi3? is salicylhydroximate; and iph2? is isophthalate. The manganese(III) ions and shi3? ligands generate the 12-MC-4 framework with one LnIII and Na+ ion bound to each [12-MCMn(III)N(shi)-4] on opposite sides of the central MC cavity. The carboxylate groups of the isophthalate ligands bridge between the central LnIII ion and each ring MnIII ion, and the meta-arrangement of the carboxylate groups joins two LnNa[12-MCMn(III)N(shi)-4] units together to form the dimer through the LnIII ions, which reside on the interior of the molecule. The identity of the central LnIII ion slightly impacts the size the [12-MCMn(III)N(shi)-4] framework. As the crystal radius of the LnIII ion increases from LuIII (1.02 Å) to LaIII (1.19 Å), the 12-MC-4 framework expands to accommodate the larger LnIII ion as the MC cavity increases in size (0.53 Å for LuIII to 0.58 Å for LaIII) and the average cross cavity MnIII-MnIII and oxime oxygen-oxime oxygen distances also increase (MnIII-MnIII distances: 6.48 Å for LuIII to 6.52 Å for LaIII; Ooxime-Ooxime distances: 3.66 Å for LuIII to 3.75 Å for LaIII). In addition, the larger LnIII ions reside further from the MC cavity as indicated by the LnIII-oxime oxygen mean plane (OoxMP) distance. The LnIII-OoxMP distance steadily decreases from LaIII (1.7527(12) Å) to LuIII (1.5575(15) Å).

Graphic Abstract

The complex {LaNa[12-MCMn(III)N(shi)-4]}2(iph)4(DMF)6(H2O)2 is a dimer of [12-MC-4] molecules linked by four isophthalate anions

  相似文献   

16.
Abstract  A pair of CuII coordination isomers [Cu(pmt)2] · 4H2O (1) and {[Cu(pmt)2] · 2H2O} n (2) [Hpmt = 2-(2-pyridylmethylamino) ethanesulfonic acid] have been prepared by reaction of the same proportion CuCl2 · 2H2O and Hpmt but with different experimental methods in water–methanol mixed solution, and were characterized by X-ray diffraction, elemental analysis, IR spectrum. X-ray analysis indicates that complex (1) is a mononuclear complex in which two deprotonated pmt ligands coordinate in a facial tridentate arrangement about the CuII atom. While complex (2) is a coordination polymer, in which four N atoms of pmt ligands coordinate to one CuII atom but its sulfonate O atoms bond to adjacent CuII atom. Thus 12-membered rings (–Cu–N–C–C–S–O–)2 are obtained between two neighbouring CuII atoms and they connect one another to form this new polymer. Crystal data: [Cu(pmt)2] · 4H2O (1), Mr = 566.10, monoclinic, P2 1/c, a = 9.1950(8) ?, b = 11.5093(10) ?, c = 11.2304(10) ?, β  = 105.5550(10)°, Z = 2, V = 1144.96(17) ?3, R 1  = 0.0407, wR 2  = 0.1242 [I > 2σ (I)]; {[Cu(pmt)2] · 2H2O} n (2), Mr = 530.07, triclinic, P-1, a = 7.6165(19) ?, b = 8.806(2) ?, c = 9.592(4) ?, α = 104.933(4)°, β = 106.732(4)°, γ = 109.503(3)°, Z = 1, V = 534.2(3) ?3, R 1 = 0.0470, wR 2 = 0.1082 [I > 2σ(I)]. Index Abstract  A pair of CuII coordination isomers [Cu(pmt)2] · 4H2O (1) and {[Cu(pmt)2] · 2H2O} n (2) [Hpmt = 2-(2-pyridylmethylamino) ethanesulfonic acid] have been prepared by reaction of the same proportion CuCl2 · 2H2O and Hpmt but with different experimental methods in water–methanol mixed solution.   相似文献   

17.
Two Zn(II)-containing complexes based on fluconazole, {[Zn(HFlu)2(IPA)]·9H2O}n (1), {[Zn(HFlu)2(OH-BDC)]·8H2O}n (2) (HFlu = fluconazole; 2-(2,4-difluoro- phenyl)-1,3-bis(1,2,4-triazol-1-yl)-propan-2-ol; H2IPA = isophthalic acid; OH-H2BDC = 5-hydroxyisophthalic acid) have been synthesized and structurally characterized. Complex 1 and 2 are both a one-dimensional (1D) tubular structure with the distorted dinuclear zinc rectangular-shaped cavity, and large free water molecules involved in strong O?H···O and O?H···N hydrogen bonds are accommodated in the 1D tubular structure. The thermal stabilities and photoluminescent properties of the coordination polymers have also been investigated.  相似文献   

18.
The single crystal structure of NH4[UO2(CH3COO)3] (I), K[UO2(CH3COO)3] (II), and Cs[UO2(CH3COO)3] (III) is studied by X-ray diffraction. I and II crystallize in the tetragonal crystal system. The crystal data are as follows: a = 13.6985(3) and c = 27.5678(14) ?, V = 5173.1(3) ?3, space group I41/a, Z = 16, and R = 0.023 for I; a = 13.8890(5) and c = 26.0839(18) ?, V = 5031.7(4) ?3, space group I41/a, Z = 16, and R = 0.037 for II. Crystals III are orthorhombic, a = 18.176(2), b = 13.119(2), and c = 22.088(4) ?, V = 5267(1)?3, space group Pbca, Z = 16, and R = 0.0424. In structures I–III, the uranium-containing structural units are represented by discrete mononuclear [UO2(CH3COO)3] groups, which belong to the AB 301 (A = UO22+, B 01=CH3COO) crystal chemical group of uranyl complexes.  相似文献   

19.
The crystal structures of three Pd(II) compounds with diamine tetracarboxylates in different protonation states are determined, namely, [Pd(H2 Cdta)] · H2O (I), [Pd(H3 EdtpCl] · 2H2O (II), and (H6 Edtp)[PdCl4] · 4H2O (III) (R 1 = 0.0230, 0.0313, and 0.0277 for 3040, 3377, and 3809 reflections with I > 2σ(I) for I–III, respectively). Crystals I and II are built of neutral complexes [Pd(H2 Cdta)] and [Pd(H3 Edtp)Cl], respectively, and crystallization water molecules. Crystal III consists of [PdCl4]2− anionic complexes, H6 Edtp 2+ cations, and water molecules. In I, one of the protonated acetate groups of the H2 Cdta 2− ligand forms a very weak additional Pd-O bond [2.968(2) Å] over the 2N + 2O coordination square. In II and III, the protonated propionate groups of the H3 Edtp ligand and the H6 Edtp 2+ cation are not involved in Pd coordination and the coordination squares consist of the 2N + O + Cl and 4Cl atoms, respectively. __________ Translated from Kristallografiya, Vol. 48, No. 2, 2003, pp. 278–282. Original Russian Text Copyright ? 2003 by Polyakova, Poznyak, Sergienko.  相似文献   

20.
Abstract  Two new coordination polymers {[Tb2(C4H4O5)3 · 4H2O] · 2H2O} n (1) and {[La2(C4H4O5)3 · 3H2O] · 3H2O} n (2) (C4H4O5 2− = diglycolato) were prepared by hydrothermal reaction and characterized by X-ray crystallography. The two complexes have different network structures through carboxylate oxygen atoms and ether oxygen atoms from diglycolato ligands linking lanthanide ions. The characteristic transition bands 5D→ 7FJ (J = 6 − 3) of Tb(III) ion are observed in complex 1. Graphical Abstract  Two new coordination polymers {[Tb2(C4H4O5)3 · 4H2O] · 2H2O} n (1) and {[La2(C4H4O5)3 · 3H2O] · 3H2O} n (2) (C4H4O5 2− = diglycolato) have network structures through the carboxylate oxygen atoms and ether oxygen atoms from diglycolato ligands. The emission spectrum of complex 1 indicates the 5D→ 7FJ (J = 6 − 3) transitions of Tb(III) ion.   相似文献   

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