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1.
A new complex [Cu(phen)3][(C6H4)2C(OH)COO]2·6H2O was prepared by selfassembly of benzilic acid, 1,10-phenanthroline (phen), and copper perchlorate. It crystallizes in triclinic, space group P1-, with a = 1.14661(17), b = 1.6455(2), c = 1.6457(2) nm, α= 74.779(2), β = 74.904(3), γ = 84.424(3)°, V = 2.8914(7) nm^3, Dc = 1.340 g/cm^3, Z = 2, F(000) = 1218, GOOF = 1.018, the final R = 0.0643 and wR= 0.1633. The crystal structure shows that the copper ion is coordinated with six nitrogen atoms from six 1,10-phenanthroline molecules, forming a distorted octahedral coordination geometry.  相似文献   

2.
1 INTRODUCTION Benzoic acids with substituent of amino are a class of rigid ligands possessing several functional groups. When they coordinate to metal ions, versa- tile coordination modes will be presented with pre- sence of not only coordinate-covalent bonds but also hydrogen bonds. Besides, diverse coordination modes of carboxyl and rigid frame of benzene ring gua- rantee the stability of multi-dimensional structures of the synthesized metal complexes. Thus ligands of this class are o…  相似文献   

3.
A new ternary copper(II) complex,[C 43 H 27 Cu 2 N 7 O 5 ]·[C 14 H 6 CuN 2 O 8 ]·6.5H 2 O,has been synthesized by the reaction of copper sulfate,2,6-pyridinedicarboxylic acid and 1,10-phenanthroline (phen),and characterized by elemental analysis,IR,UV and X-ray single-crystal diffraction.It crystallizes in triclinic,space group P1,with a=14.379(5),b=15.510(5),c=15.835(6),α=78.567(6),β=63.594(6),γ=81.287(6)°,V=3092.1(19)3,C 57 H 46 Cu 3 N 9 O 19.5,M r=1359.54,Z=2,D c=1.446 Mg/m 3,λ(MoKα)=0.71073,μ=1.101 mm-1,F(000)=1362,S=1.071,the final R=0.0718 and wR=0.11960 for 10705 observer reflections (I > 2σ(I)).The structure unit of the title complex consists of a mononuclear part and a di-nuclear part,and the three copper ions show three coordination modes.Each 6-coordinated geometry of the Cu atom is a distorted octahedral coordination geometry.The 3D supramolecular system is formed by the hydrogen bond O-H···O and π-π stacking interaction between neighboring single cells.The antibacterial activity of the title complex is also studied.  相似文献   

4.
A new metal-organic complex Mn2(cbba)4(phen)2 (Hcbba = 2-(4'-chlorine-benzoyl)- benzoic acid, phen = 1,10-phenanthroline) 1 has been hydrotherrnally synthesized and structurally characterized by single-crystal X-ray diffraction, elemental analyses and IR spectroscopy. The compound crystallizes in orthorhombic, space group Pbcn with α = 12.154(5), b = 18.166(7), c = 31.197(13) A, V = 6887(5) A^3, C80H48Cl4Mn2N4O12, Mr= 1508.90, Dc = 1.455 g/cm^3, μ(MoKα) = 0.591 mm^-1, F(000) = 3080, Z = 4, the final R = 0.0408 and wR = 0.0873 for 4033 observed reflections (I 〉 2σ(I)). In the crystal structure, the manganese atom is six-coordinated with four carboxylate oxygen atoms from three different cbba ligands and two nitrogen atoms from phen ligands, showing a distorted octahedral geometry. Furthermore, it exhibits a 3D supramolecular network through π-π interactions.  相似文献   

5.
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7.
1 INTRODUCTION The functions of transition metals present in the active sites of metalloproteins range from stabilizing the protein structure, affecting the enzymatic activity to controlling the cell metabolism[1]. Copper con- tained metalloproteins are quite widespread, with copper exhibiting various coordination numbers and geometries[2, 3]. Characterization of the model copper complexes mimicking copper-proteins has led to the better understanding of the chemistry of copper in biologic…  相似文献   

8.
It is important to research the mixed-ligand copper complexes containing bioligands, such as amino acids, nucleic acids and proteins, in exploring the functional mechanism of microelement copper in organism because the reaction of any micronutrient with two or more bioligands in the concentrated bioligands background gives mixed-ligand ternary complexes, which are more stable and related with storage of substance and transportationof metal ions in the life process.  相似文献   

9.
A new metal-organic complex Co2(cbba)4(phen)2(μ2-OH2)(H2cbba=2-(4'-chlorine-benzoyl)benzoic acid,phen=1,10-phenanthroline) 1 has been hydrothermally synthesized and struc-turally characterized by single-crystal X-ray diffraction,elemental analyses,TG and IR spectroscopy.The compound crystallizes in triclinic,space group P1 with a=10.7659(7),b=17.1856(11),c=19.2022(13),α=83.8120(10),β=84.9930(10),γ=87.2070(10)°,V=3515.8(4)3,C80H50Cl4Co2N4O13,Mr=1534.90,Dc=1.450 g/cm3,μ(MoKα)=0.693 mm-1,F(000)=1568,Z=2,the final R=0.0490 and wR=0.1092 for 8216 observed reflections(Ⅰ > 2σ(Ⅰ)).In the crystal structure,the cobalt atom is six-coordinated with three carboxylate oxygen atoms from three different cbba ligands,one oxygen atom from coordinated water molecule and two nitrogen atoms from phen ligand,showing a distorted octahedral geometry.Furthermore,it exhibits a 3D supramolecular network through π-π and hydrogen bonding interactions.  相似文献   

10.
IntroductionThe syntheses of metal-organic coordination poly-mers have been attracting increasing attention owing tothe potential applications of their functional materials incatalysis,non-linear optics,magnetism sensors andmolecular recognition[1—7].Coordination polymers crys-tallized from polyaromatic acids and metal-ions are ofgreat interest for their polymeric structures and porousproperties[8—12].Their network topologies based on mo-lecular building blocks are usually controlled and mod…  相似文献   

11.
1 INTRODUCTION In recent years, coordination polymeric frame- works have attracted great attention not only due to their potential applications in the areas of magnetism, nonlinear optics, electronics, catalysis, and molecu- lar recognition and sorption but also to their intri- guing structure topologies[1~8]. The coordination polymers can be specially designed by careful selec- tion of the metal ions with definite coordination geometry, the structure of the connecting ligands, the nature…  相似文献   

12.
A novel coordination polymer [Mg(L)(H2O)2]·H2O] (LH2=L-cysteic acid) has been synthesized and characterized by elemental analysis, IR and single-crystal X-ray diffraction.The crystal crystallizes in orthorhombic system, space group P212121, with a=5.962(3), b=11.224(6), c=13.664(7)(A), V=914.3(8) (A)3, Z=4, Mr=245.50, Dc=1.783 g/cm3,μ=0.445 mm-1,flack parameter=0.32(16), F(000)=512, the final R=0.0458 and wR=0.1172 for 1578 observed reflections with I > 2σ(Ⅰ). The Mg(Ⅱ) atom shows an octahedral geometry defined by two carboxyl O atoms from two different L-cysteic acid ligands, one carboxyl O atom and one amino N atom from the adjacent ligand, and two aqua ligands. The Mg(Ⅱ) atoms are bridged by L-cysteic acid ligands, leading to a 1D infinite zigzag chain. In the structure there are extensive hydrogen bonds,through which the complex completes its 3D framework structure.  相似文献   

13.
A new mononuclear Cu(Ⅱ) dithiocarbamate complex CuI(prdtc)(phen) 1 (prdtc = N-pyrrolidinyldithiocarbamate, phen = 1,10-phenanthroline) was synthesized and characterized by elemental analysis, IR spectrum, and single-crystal X-ray diffraction. The crystal belongs to the monoclinic system, space group P21/c with a = 8.7110(9), b = 14.7143(14), c = 14.8507(15) A, β = 109.721(6)°, V = 1791.9(3) A3, Z = 4, Dc = 1.916 g/cm3, CI7H16CulN3S2, Mr = 516.89, λ(MoKa) = 0.71073A,μ = 3.178 mm^-1, F(000) = 1012, the final R = 0.0369 and wR = 0.0987. A total of 4082 unique reflections were collected, of which 2916 with I 〉 2σ(I) were observed. The Cu(Ⅱ) atom is five-coordinated in a distorted square-pyramidal geometry by one I atom in the apical position, two S atoms from a prdtc ligand and two N atoms from a phen ligand in the basal plane. There exist face-to-face aromatic π-π stacking interactions between adjacent phen ligands stabilizing the structure and making the complex assemble into a 1D structure along the a axis. It can be concluded that the difference of the dtc flexibility and reaction conditions result in the structural difference between complex 1 and CuI(dmdtc)(phen) (dmdtc = N, N-dimethyldithiocarbamate).  相似文献   

14.
By hydrothermal synthesis, a manganese(H) tetracarboxylate [Mn(2,2′-bipyridi- ne)(btec)0.5(HEO)]En (H4btec = 1,2,4,5-benzenetetracarboxylic acid) was obtained and characterized by single-crystal X-ray diffraction, IR, elemental analysis and thermogravimetric analysis. It crystallizes in triclinic, space group P1, with a = 7.721(4), b = 8.905(5), c = 10.712(6)A, a = 80.899(8), β = 70.371(8), y = 78.201(8)°, Z = 2, V= 675.8(7)A3, Mr= 354.20, De= 1.741 g/cm^3,μ = 1.007 mm^-1, F(000) = 360, S = 0.956, (△/σ)max = 0.000, the final R = 0.0490 and wR = 0.1262. This compound presents an infinite 1D polymer featuring a double-chain structure. The Mn(Ⅱ) ion is five-coordinated. The four carboxylate groups of btec4- are all deprotonated and coordinated to four Mn atoms in a monodentate fashion, forming a 1D double chain structure with a cavity. Such chains are interconnected by π-π stacking interactions into 2D layers which are further interlinked into a supramolecular structure by hydrogen bonds.  相似文献   

15.
A new one-dimensional polymeric complex [Cd(SCN)2(H2O)]L (L = N,N′-bis(furan- 2-ylmethylene)hydrazine) has been synthesized and characterized by IR, UV spectra, TG-DTA technique and single-crystal X-ray diffraction analysis. It crystallizes in triclinic, pace group P1^- with a = 5.9268(8), b = 10.8678(15), c = 13.3671(19) A, α = 109.295(2), β = 95.092(2), γ = 97.8580(10)°, V = 796.70(19)A^3, Z = 2, C12H10CdN4O3S2, Mr = 434.76, μ = 1.648 mm^-1, Dc = 1.812 g/cm^3, F(000) = 428, R = 0.0308 and wR = 0.0769. The crystal structure reveals that the structure of [Cd(SCN)2(H2O)]n features di-μ-1,3-thiocyante bridges and 1D chains. The octahedrally coordinated Cd atom is surrounded by one oxygen atom from water molecule, three S atoms and two N atoms from five di-μ-1,3 thiocyanato bridges. The Cd atoms are connected by two di-μ-1,3 thiocyanato bridges with the Cd(1)…Cd(1A) separation of 4.239(1) A and Cd(1)...Cd(1B) of 5.852(1)/~. In addition, the one-dimensional straight chain structure is further connected by multiform intermolecular N-H…O hydrogen bonds and π-π interactions to form a three-dimensional supramolecular structure.  相似文献   

16.
蔡晓庆  胡茂林  陈帆 《结构化学》2007,26(1):103-107
1 INTRODUCTION The construction of coordination polymers based on metal centers and multifunctional bri- dging ligands is of great interest currently owing to their novel topologies and potential applica- tions in magnetism, catalysis, molecular recogni- tion, ion exchange, small molecular inclusion, nonlinear optical behavior, electrical conductivity, molecular sensing, and, in general, the rational design of new materials[1~4]. As is well known, ligands containing carboxylate groups are…  相似文献   

17.
1 INTRODUCTION The research on organic polyamines is currently of great interest because of their potential applica- tions as useful organic ligands, in which the amine nitrogen atoms have strong coordination ability to the transition metal ions and recognition function[1~4]. Their transition metal complexes play an excellent role in catalysis and mimic studies on dismutase and chlorophyll[5~7]. Therefore much attention has been focused on their syntheses and applications[8~11]. Our group…  相似文献   

18.
19.
A new compound,[Zn(L)(1,4-chdc)]2·2H2O(1,1,4-chdc = 1,4-cyclohexanedicarboxylate and L = 11-fluoro-dipyrido[3,2-a:2,3-c]phenazine),has been synthesized under hydrothermal conditions and characterized by single-crystal X-ray diffraction.The crystal of 1 belongs to triclinic,space group P1 with a = 9.4679(19),b = 10.915(2),c = 12.577(3) ,α = 77.22(3),β = 74.73(3),γ = 65.47(3)°,C52H39F2N8O10Zn2,Mr = 1104.65,V = 1131.4(4) 3,Z = 1,Dc = 1.621 g/cm3,S = 1.091,μ(MoKα) = 1.143 mm–1,F(000) = 565,R = 0.0426 and wR = 0.1171.In 1,two 1,4-chdc anions bridge two Zn(Ⅱ) atoms to form a dimer.The neighboring dimers are further extended by π-π stacking interactions to form a 2D supramolecular layer.The luminescent property of the compound has also been investigated.  相似文献   

20.
徐占林  刘福义  徐野  王佳  李远  王秀艳 《结构化学》2014,33(10):1516-1520
A new coordination polymer, [Cd2(bptc)(L)2(H2O)2]·5H2O(1, L = 2-(2-chloro-6-fluorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline and H4 bptc = 3,3',4,4'-biphenyltetracarboxylic acid), has been synthesized under hydrothermal conditions and characterized by single-crystal X-ray diffraction. The crystal belongs to monoclinic, space group P21/n with a = 18.868(4), b = 7.2111(14), c = 19.464(4), β = 95.75(3)°, C54H31Cd2Cl2F2N8O15, Mr = 1365.57, V = 2635.0(9)3, Z = 2, Dc = 1.721 g/cm3, S = 1.034, μ(MoKα) = 0.995 mm–1, F(000) = 1358, R = 0.0501 and wR = 0.1076. In 1, each bptc anion bridges four Cd(II) atoms to form 2D layer structures, which are further extended by π-π stacking interactions into a 3D supramolecular architecture. The thermal behavior and luminescent properties of the compound have also been studied.  相似文献   

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