一维配位聚合物[Cu(2-pac)2·2H2O]n的合成与结构

近年来,配位聚合物由于在光学、电学、磁学、催化、分离及吸附等方面具有潜在的功能性,处于化学、材料、生物、物理等许多学科的交叉点,成为当前最活跃的前沿研究领域之一[1～8],因此进一步合成具有特定结构和功能的配位聚合物具有非常重要的意义和价值[9～12].     

一维链状配位聚合物[Ag(bix)(NO3)(H2O)]n的合成和晶体结构

A one-dimensional (1D) Z conformation coordination polymer, [Ag(bix)(NO₃)(H₂O)]_n was obtained by the reaction between AgNO₃ and flexible ligand of 1,4-bis(imidazol-1-ylmethyl)-benzene under hydrothermal conditions. It crystallizes in triclinic with space group P1. The crystallographic data of the compound are: a=0.777 1(2) nm, b=1.043 4(3) nm, c=1.082 7(3) nm, α=71.403(4)°, β=80.946(5)°, γ=88.794(4)°. The 1D chainlike structure was connected by π-π interaction between phenyl rings, leading to a 2D layered network. The lattice water and the NO₃^- anions were involved between the layers, therefore the 2D layered structure further extended to an intricate 3D framework. CCDC: 257100.     

一维链状锌配位聚合物{[Zn(H2O)2(L)(phen)]·3H2O}n的合成、晶体结构和性能研究

合成了一种锌配位聚合物{[Zn(H₂O)₂(L)(phen)]·3H₂O}_n (1), 其中, H₂L=1-氨基-8-萘酚-3, 6-二磺酸并利用元素分析、红外、紫外、荧光、热重和X-射线单晶衍射分析进行了表征。标题配合物属正交晶系, Pnma空间群, a=1.698 90(12) nm, b=0.661 88(11) nm, c=2.480 40(14) nm, V=2.789 1(5) nm³, Z=4, M_r=634.92, D_c=1.512 g·cm^-3, R=0.058 6, wR=0.121 4。标题配合物呈现一维链状结构, 链内L²-和phen配体之间存在π-π堆积作用, 链与链之间通过氢键扩展为二维超分子网络。     

一维链状铜配位聚合物[Cu(m-BDOA)(bipy)·H2O]n的合成与晶体结构

A novel coordination polymer, [Cu(m-BDOA)(bipy)·H₂O]_n (m-BDOA^2-=benzene-1,3-dioxyacetate), was synthesized and characterized by elemental analysis, IR spectra, X-ray single crystal structure analysis. Crystallographic data are as follows: orthorhombic, space group Pna2₁, a=1.606 9(3) nm, b=1.685 9(3) nm, c=0.699 7(1) nm, V=1.8955(7) nm³, Z=4, D_c=1.619 g·cm^-3, μ=1.200 mm^-1, F(000)=948，R=0.038 1, wR=0.038 6. The copper atom is five-coordinated involving two oxygen atoms of different m-BDOA^2- ligand, two nitrogen atoms of 2,2′-bipy ligand and one coordinated water, there is a distorted square pyramidal environment. Two copper atoms are bridged by m-BDOA^2- ligand, forming a one-dimensional chain along a axis. The adjacent distance of Cu…Cu atoms is 0.877 3nm. The crystal network was formed by the intermolecular hydrogen bond and π-packing interactions.     

二维层状配位聚合物{[Cd(p-CMSP)(Him)(H2O)]·3H2O}n

The novel coordination polymer {[Cd(p-CMSP)(Him)(H₂O)]·3H₂O}_n ( p-CMSP^2-=p-(carboxymethoxy)phenylthioacetate, Him=imidazole) was synthesized by the reaction of Cd(NO3)₂, imidazole and p-(carboxymethoxy)phenylthioacetic acid in an aqueous solution, and characterized by elemental analysis, IR, TG and single crystal X-ray diffraction. The crystal structure is of monoclinic, space group P2₁/c with a=1.144 0(2) nm, b=1.876 7(4) nm, c=0.877 89(18) nm, β=106.31(3)° and V=1.808 9(7) nm³, Z=4, R=0.023 2, wR=0.051 4. Each Cd(II) atom displays a distorted octahedral coordination geometry, defined by three carboxyl O atoms from different p-CMSP^2- ligands, one S atom from thioether, one N atom from imidazole and one water molecule. Adjacent Cd(II) ions are bridged by p-CMSP^2- groups, resulting in a 2D layer structure. The adjacent Cd…Cd distances are 0.492 7 nm and 1.144 0 nm. Furthermore, such layers are linked through hydrogen bonds to form supramolecular network. CCDC: 269474.     

配位聚合物{[Co(4,4′-bpy)(H2O)4](Fum)·4H2O}n的合成和晶体结构

The complex {[Co(4,4′-bpy)(H₂O)₄](Fum)·4H₂O}_n(where 4,4′-bpy = 4,4′-bipyridine and Fum = fumarate) was synthesized and characterized by X-ray diffraction. The complex consists of one-dimensional chains containing cobalt(Ⅱ) ions bridged by 4,4′-bpy molecules. The six-coordination of Co²⁺ is achieved by means of four water molecules. The fumarate is not coordinated to cobalt ion while it forms hydrogen bonds with coordinated and non-coordinated water molecules and extends the structure into three-dimensional hydrogen bonding network. CCDC: 190488.     

一维交替链状稀土配位聚合物[Er(dpa)(pya)(H2O)]n和[Nd2(pya)6(H2O)4]n的水热合成及结构表征

在水热条件下，稀土氧化物与2，2′-联苯二甲酸及异烟酸反应得到了两个新颖的一维交替链状配位聚合物[Er(dpa)(pya)(H₂O)]_n和[Nd₂(pya)₆(H₂O)₄]_n(H₂dpa=2，2′-联苯二甲酸；Hpya=异烟酸)。测定了它们的晶体结构，并进行了红外光谱和元素分析等 性质的表征。晶体结构测定表明这两个化合物同属单斜晶系，并具有相同的空间群P2₁/n， 晶体学参数分别为配合物1：a= 0.8830(3) nm，b=1.058 5(3) nm，c=2.089 1(6) nm，β=98.429(4)°，D_c=1.883g·cm^-3， V=1.931 4(10) nm³，Z=4； 配合物2：a=0.968 9(4) nm，b=1.978 3(9) nm，c=1.164 2(6) nm，β=112.106(7)°，D_c=1.756 g·cm^-3，V=2.067 5(17) nm³，Z=4。     

一维链状配位聚合物[Cu3(TFSSB)2·(H2O)4·4H2O]n的合成和晶体结构

The title complex [Cu₃(TFSSB)₂·(H₂O)₄·4H₂O]_n (TFSSB=taurine 3-formylsalicylic schiff base) was synthesized by TFSSB and copper(Ⅱ) acetate monohydrate in ethanol solution and the crystal structure was determined by X-ray diffraction method. The crystal belongs to monoclinic system, space group P2₁ / n，with cell parameters: a=0.927 9(6) nm, b=1.173 0(2) nm, c=1.471(2) nm, β=106.96(2)°, and V=1.531(2) nm³, Z=2, D_c=1.890 g·cm^-3, μ=2.291 mm^-1, F(000)=882, R₁=0.025 9, wR₂=0.065 9. The Cu1 is five-coordinate, the Cu2 is four-coordinate. CCDC: 253298.     

一维链状的3-羧基苯氧乙酸铜配位聚合物[Cu(3-cpoa)(phen)(H2O)]n的合成与晶体结构

A novel coordination polymer [Cu(3-cpoa)(phen)(H₂O)]_n(3-cpoa^2-=3-carboxylphenoxyacetate, phen=1,10-phenanthroline) was synthesized and characterized by elemental analysis, IR spectra and single crystal X-ray diffraction. Crystallographic facts are as follows: monoclinic crystal system, space group P2₁/n， a=0.688 96(14) nm， b=1.652 3(3) nm， c=1.651 1(3) nm， β=95.20(3)°, V=1.871 9(6) nm³, Z=4, D_c=1.618 g·cm^-3， F(000)=932， μ=1.211 mm^-1，R=0.048 2 and wR=0.062 2. The copper atom exhibits a distorted square pyramidal coordination geometry, involving two oxygen atoms of different 3-cpoa^2- ligands, two nitrogen atoms of 1,10-phen ligand and one coordinated water molecule. The copper atoms are bridged by 3-cpoa^2- ligand, forming a one-dimensional chain along c axis. The distance of adjacent Cu…Cu is 0.916 6(4) nm. A three-dimensional network structure is constructed by the intermolecular hydrogen bond and π-stacking interactions. CCDC: 219724.     

一维链状镉(Ⅱ)配位聚合物[Cd(μ-DPIA)2(H2O)]n的合成与结构研究

A novel one-dimensional coordination polymer, [Cd( μ-DPIA)₂(H₂O)]_n (HDPIA=4,5-Diphenylimidazole-1-acetic acid), was synthesized and characterized by the element analysis, IR and single crystal X-ray diffraction. It crystallizes in the orthogonal space group Pca2₂ with unit cell parameters: a=1.509 6(3) nm, b=0.611 1(1) nm, c=3.216 4(6) nm, and V=2.967 1(10) nm³, Z=4, R=0.032 7, wR=0.086 7. The Cd atom is seven-coordinated by four O atoms and two N atoms from two chelating DPIA^- ligands and one water molecule, and displays a distorted pentagonal bipyramid coordination geometry. Each DPIA^- ligand bridges two adjacent Cd atoms, forming a infinite chain along the a axis direction. The Cd…Cd separation within the polymer is 0.765 0(3) nm. A layer structure which parallels to the ab plane is further constructed by hydrogen bonding interactions. CCDC: 254247.     

一维链状镉配位聚合物[Cd(phen)(2，4，6-TMBA)2(H2O)]n的水热合成、晶体结构及热稳定性

在甲醇和水的混合溶剂中用2，4，6-三甲基苯甲酸(2，4，6-TMBA)、邻菲咯啉(phen)、高氯酸镉为原料采用水热法合成了一维链状配位聚合物Cd(phen)(2，4，6-DMBA)₂(H₂O)。该配合物晶体属四方晶系，空间群I4₁。晶体中镉原子与1个邻菲咯啉的2个N原子、2个2，4，6-三甲基苯甲酸酸根中的3个羧基氧原子及1个水分子中的氧原子配位，晶胞参数:a=2.042 5(7) nm，c=1.395 2(5) nm，V=5.820(3) nm³，D_c=1.454 g·cm^-3，Z=8，F(000)=2 608，GooF=1.064，R₁=0.034 8，wR₂=0.070 4。形成六配位的变形八面体结构。对晶体进行了热稳定性分析，结果表明:配合物在240.0 ℃以下稳定性好。     

一维链状锰配位聚合物[Mn(3,5-Me2PhCO2)2(phen)]n的合成与晶体结构

A manganese coordination polymer [Mn(3,5-Me₂PhCO₂)₂(phen)]_n(phen=1,10-phenanthroline) has been synthesized by hydrothermal methods. The crystal structure was determined by single-crystal X-ray diffraction. The crystal is of triclinic, space group P1 with a=0.770 3(4) nm, b=1.145 2(6) nm, c=1.537 0(9) nm, α=78.182(9)°, β=77.170(9)°, γ=89.784(9)°, V=1.292 8(12) nm³, Z=2, M_r=533.47, D_c=1.370 g·cm^-3, μ=0.549 mm^-1, F(000)=554, R_int=0.043 4, R=0.060 8 ,wR=0.148 4. In the crystal the manganese atom is six-coordinated by two nitrogen atoms from phen and four oxygen atoms from four 3,5-dimethylbenzolate molecules, completing an octahedral geometry. And the title complex forms one-dimensional chain structure through bridging 3,5-dimethylbenzolate molecules. CCDC: 642920.     

一维链状配位聚合物[Cd{5-(NO2)sal}2(2,2′-bipy)]n的合成与晶体结构

A coordination polymer of [Cd{5-(NO₂)sal}₂(2,2′-bipy)]_n(5-(NO₂)sal=5-nitrosalicylate, 2,2′-bipy=2,2′-bipyridine) was synthesized by hydrothermal reaction and characterized by elemental analysis, IR and X-ray diffraction single crystal structure analysis. The title complex crystallizes in monoclinic with space group C2/c, a=2.730 8(16) nm, b=1.272 3(5) nm, c=0.674 5(3) nm, β=96.73(2)°, V=2.327(2) nm³, Z=4, R=0.022 2, wR=0.057. The 5-nitrosalicylate anions doubly bridge the Cd(Ⅱ) atoms to form one-dimensional polymeric chain with the repeated eight-membered ring units (Cd-O-C-O)₂. The crystal structure is stabilized by intra- and interchain hydrogen bonds interactions. CCDC: 694568.     

一维链状4-硝基-3-羧甲基苯异丙酸镉配位聚合物{[Cd(3-CNPP)(Py)3]·2H2O}n的合成、晶体结构及热稳定性研究

A novel one-dimensional coordination polymer, {[Cd(3-CNPP)(Py)₃]·2H₂O}_n (3-CNPP^2-=2-(3-carboxymethyl-4-nitrophenyl)propionate dianion, Py=pyridine) was synthesized and characterized by the element analysis, IR, TG and single crystal X-ray diffraction. The title complex crystallizes in monoclinic system with space group P2₁/ n, a=0.974 81(19) nm, b=1.992 3(4) nm, c=1.459 8(3) nm, β=95.92(3)°, and V=2.820 0(10) nm³ Z=4, R=0.037 3, wR=0.083 8. Each cadmium(Ⅱ) atom is seven-coordinated by four oxygen atoms from two different 3-CNPP^2- groups and three nitrogen atoms from three pyridine ligands, forming a distorted pentagonal bipyramindal coordination geometry. The cadmium(Ⅱ) atoms are bridged by the tetradentate 3-CNPP^2- groups, constructing a one-dimensional zigzag chain structure along c axis. The adjacent distance of Cd…Cd atoms is 0.979 6 nm. The two-dimensional hydrogen-bonding supramolecular network was formed via the hydrogen bond interactions. CCDC: 254257.     

一维链状4-羧基苯氧乙酸桥联钴配位聚合物[Co(p-CPOA)(2，2′-bipy)(H2O)]n的合成与晶体结构

A novel coordination polymer of [Co(p-CPOA)(2，2′-bipy)(H₂O)]_n (p-CPOA^2-=4-carboxylphenoxyacetate dianion, 2,2′-bipy=2,2′-bipyridine) was synthesized and characterized by elemental analysis, IR and X-ray single crystal diffraction. The title complex crystallizes in monoclinic space group C2/c, with a=1.424 4(3) nm, b=1.316 6(3) nm, c=1.947 7(4) nm, β=104.56(3)°. V=3.535 3(14) nm³, Z=8, R=0.028 5, wR=0.089 1. The cobalt(Ⅱ) ion displays a distorted octahedral coordination geometry, defined by three carboxyl oxygen atoms from different p-CPOA^2- groups, two nitrogen atoms from 2,2′-bipyridine ligand and one water molecule. The cobalt atoms are bridged by p-CPOA^2- groups, forming a one-dimensional chain structure along a axis. The adjacent Co…Co atoms distance is 0.996 8 nm. A layer supramolecular network is contrsucted by the hydrogen bonds and π-π stacking interactions. CCDC: 220039.     

一维链状镉(Ⅱ)配位聚合物{[Cd(PAc)2(4，4′-bipy)(H2O)]·4H2O}n的合成、晶体结构及热稳定性研究

A novel one-dimensional coordination polymer, {[Cd(PAc)₂(4,4-bipy)(H₂O)]·4H₂O}_n (HPAc=phenyl acetic acid, 4,4′-bipy=4,4′-bipyridine) was synthesized and characterized by element analysis, IR, TG and X-ray single diffraction crystal structure determination. It crystallizes in the monoclinic space group C2/c with a=2.088 5(4) nm, b=0.839 05(17) nm, c=1.683 5(3) nm, β=105.45(3)° and V=2.843 5(10) nm³, Z=4, M_r=628.94, F(000)=1 288, μ=0.820 mm^-1, R=0.019 9, wR=0.056 5. Each cadmium(Ⅱ) atom is seven-coordinated by four oxygen atoms from two different phenyl acetate groups and two nitrogen atoms from two 4,4′-pyridine ligands and one water molecule, forming a distorted pentagonal bipyramid coordination geometry. Adjacent cadmium(Ⅱ) atoms are bridged by 4,4′-pyridine ligand, constructing a infinite chain along the diagonal direction of ac plane. The Cd…Cd separation within the polymer is 1.164 6(4) nm. The three-dimensional supramolecular structures of the title complexes are constructed by hydrogen bonding interactions and π-π stacking interactions between the benzene rings of HPAc and 4,4′-bipy. CCDC: 616697.     

新颖一维配位聚合物[Ni(3，5-pdc)(H2O)4]·(H2O)的合成与晶体结构

The hydrothermal reaction of 3,5-pyridinedicarboxylic acid and NiCl₂·6H₂O results in a novel coordination polymer， [Ni(3,5-pdc)(H₂O)₄]·(H₂O). The crystal structure of the compound was determined by X-ray single crystal diffraction. The crystal belongs to monoclinic system with space group P2₁/n, a=1.136 1(3)nm, b=0.709 8(2) nm, c=1.459 7(4) nm, β=107.538(4)°， V=1.122 4(6) nm³, D_c=1.858 g·cm^-1, Z=4, F(000)=648, R₁=0.0264, wR₂=0.0665. CCDC: 224880.     

一维链状锌配位聚合物{[Zn(H2O)2(L)(phen)]·3H2O}n的合成、晶体结构和性能研究

合成了一种锌配位聚合物{[Zn(H2O)2(L)(phen)].3H2O}n(1),其中,H2L=1-氨基-8-萘酚-3,6-二磺酸并利用元素分析、红外、紫外、荧光、热重和X-射线单晶衍射分析进行了表征。标题配合物属正交晶系,Pnma空间群,a=1.698 90(12)nm,b=0.661 88(11)nm,c=2.480 40(14)nm,V=2.789 1(5)nm3,Z=4,Mr=634.92,Dc=1.512 g.cm-3,R=0.058 6,wR=0.121 4。标题配合物呈现一维链状结构,链内L2-和phen配体之间存在π-π堆积作用,链与链之间通过氢键扩展为二维超分子网络。     

配位聚合物{[Zn(TSC)(MAL)]·H2O}n的制备及结构表征

The novel Zn^Ⅱ complex, {[Zn(TSC)(MAL)]·H₂O}_n (1), where TSC is thiosemicarbazide and MAL is malonate radicle, was synthesized by self-assembling from the reaction of stoichiometric zinc chloride, thiosemicarbazide and malonic acid in solution at pH 4.5~5.0. The structural and physicochemical properties were characterized by X-ray diffraction, infrared spectroscopy, electronic spectra and thermal analysis. The crystal data for the title coordination polymer: Monoclinic, P2₁/c, β=107.808(1)°, a=0.937 59(1) nm, b=1.110 83(1) nm, c=0.921 00(2) nm, Z=2, μ=2.919 mm^-1, R₁=0.039 0, wR₂=0.099 4. The structure feature is that the bridging dicarboxylates effectively link the zinc centers to form polymeric chain in a zig-zag way, which is stabilized by N-H…O, N-H…S and O-H…O hydrogen bonds. CCDC: 231861.