Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmeth...Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmethyl)butane(bib)by a hydrothermal method,respectively.X⁃ray crystallography reveals a 2D network constructed by six⁃coordinated Ni(Ⅱ)centers,bib,and Hpdc2-ligands in complex 1,while a 2D network is built by Ni(Ⅱ)and bib ligands in 2.Furthermore,the quantum⁃chemical calculations have been performed on‘molecular fragments’extracted from the crystal structure of 1 using the PBE0/LANL2DZ method in Gaussian 16 and the VASP program.CCDC:2343794,1;2343798,2.展开更多
A polymer, [NiL（bipy）·2H2O]n（1, bipy = 4,4ˊ-bipyridine）, has been acquired by the reaction of Ni（OAc）2·4H2O with N,Nˊ-bis（2-hydroxyl-5-fluorobenzyl）-2-hydrxylpropane dii- mine in the presence of 4,...A polymer, [NiL（bipy）·2H2O]n（1, bipy = 4,4ˊ-bipyridine）, has been acquired by the reaction of Ni（OAc）2·4H2O with N,Nˊ-bis（2-hydroxyl-5-fluorobenzyl）-2-hydrxylpropane dii- mine in the presence of 4,4ˊ-bipyridine. X-ray crystallographic analysis shows that it is comprised of a mononuclear Ni（Ⅱ） complex [NiL] linked by 4,4ˊ-bipyridine. Its crystal crystallizes in the orthorhombic system, space group C2/c with a = 22.595（3）, b = 18.395（2）, c = 15.434（2） , V = 6155（1）3, Dc = 1.259 g/cm-3, Z = 8, Mr = 583.23, F（000） = 2416.0, μ（MoKa） = 0.681 mm-1, S = 1.049, R = 0.0512 and wR = 0.1108 for 6032 observed reflections（I 〉 2σ（I））. There are water hexamers in the complex. A weak overall ferromagnetic behavior has been evaluated by Curie-Weiss rule and by the formula of alternating ferro-ferromagnetic coupling in one-dimensional Ni（Ⅱ） chain, which gives g = 2.005（1） and J1 = 0.31（3） cm-1.展开更多
One new coordination polymer, [Ni（m-bix）（m-BDC）]（1, m-bix = 1,3-bis（imidazol-1-ylmethyl）benzene, m-BDC = 1,3-benzenedicarboxylic acids）, has been hydrothermally synthesized and structurally characterized by el...One new coordination polymer, [Ni（m-bix）（m-BDC）]（1, m-bix = 1,3-bis（imidazol-1-ylmethyl）benzene, m-BDC = 1,3-benzenedicarboxylic acids）, has been hydrothermally synthesized and structurally characterized by elemental analysis, IR, TGA and X-ray single-crystal diffraction. The green block crystal of complex 1（C22H18N4Ni O4） belongs to monoclinic system, space group P21/c with a = 10.0418（3）, b = 23.8651（6）, c = 8.7872（2） A, β = 112.333（3）°, V = 1947.88（9）A3, Z = 4, Dc = 1.572 g/cm^3, Mr = 461.11, F（000） = 952, R = 0.0335 and w R = 0.0683 for 2827 observed reflections（I 〉 2σ（I））. Complex 1 exhibits a novel 6-connected 3D sxd type topological framework. The magnetic characterization of complex 1 shows antiferromagnetic coupling exchange.展开更多
Two cobalt coordination polymers with the same 2D structure have been hydrothermally synthesized based on two bifunctional ligands with tetrazole and phosphonate（phosphonic acid） groups,namely,diethyl 4-（2H-1,2,3,4...Two cobalt coordination polymers with the same 2D structure have been hydrothermally synthesized based on two bifunctional ligands with tetrazole and phosphonate（phosphonic acid） groups,namely,diethyl 4-（2H-1,2,3,4-tetrazol-5-yl） benzylphosphonate（C_2H_5-L1） and 4-（2H-1,2,3,4-tetrazol-5-yl）benzylphosphonic acid（H_2L2）. The structures of the two complexes are characterized by elemental analysis,IR,TGA and X-ray single-crystal/powder diffraction. The pink block crystals of complex [Co（L1）（H_2O）]·H_2O（1） belong to the monoclinic system,space group C2/m with a = 20.8390（11）,b = 7.2695（3）,c = 10.0156（6） A,β = 109.773（7）°,V = 1427.80（13） A^3,Z = 4,D_c = 1.680 mg/cm^-3,M_r = 361.16,F（000） = 740,R = 0.0316 and wR = 0.0826 for 1702 observed reflections（I 〉 2σ（I））. The purple block crystals of complex [Co（L2）（H_2O）]·2H_2O（2） also belong to the monoclinic system,space group C2/c with a = 25.5382（16）,b = 7.3844（3）,c = 15.1925（11） A,β = 124.238（9）°,V = 2368.6（2） A^3,Z = 8,D_c = 1.969 mg/cm^-3,M_r = 351.12,F（000） = 1432,R = 0.0475,wR = 0.1617 for 2088 observed reflections（I 〉 2σ（I））. Both the nitrogen atoms of tetrazole group and oxygen atoms of phosphonate（phosphonic acid） groups in the ligands coordinated with the metal cobalt. The magnetic property of complex 1 is also investigated.展开更多
A Ni（Ⅱ） supramolecular complex,[Ni 2 （btec）（3py） 2 （H 2 O） 8 ]（H 2 O） 4 （1）,has been synthesized by Ni（ClO 4） 2 ·6H 2 O,benzene-1,2,4,5-tetracarboxylic acid （H 4 btec） and terminal ligand 3-hydro...A Ni（Ⅱ） supramolecular complex,[Ni 2 （btec）（3py） 2 （H 2 O） 8 ]（H 2 O） 4 （1）,has been synthesized by Ni（ClO 4） 2 ·6H 2 O,benzene-1,2,4,5-tetracarboxylic acid （H 4 btec） and terminal ligand 3-hydroxypyridine （3py） in aqueous solution.The title compound crystallizes in triclinic system,space group P1,with a=8.5637（12）,b=9.4138（13）,c=10.3611（14）,α=67.9540（10）,β=85.1740（10）,γ=76.9890（10）°,V=754.33（18） 3,Z=2,M r=386.96,D c=1.704 Mg/m 3,μ=1.345 mm-1,F（000）=402,the final R=0.0222 and wR=0.0563 for 2675 observed reflections with I 2σ（Ⅰ）.The adjacent discrete molecules are further self-assembled by intermolecular π-π and O-H···O hydrogen bonding interactions to construct a 3D supramolecular framework.Magnetic measurement shows weak ferromagnetic interaction in the range of 2～300 K.展开更多
A new binuclear complex [Ni2（2,2＇-bpy）2（C8H3NO6）2（H2O）4] 1 （2,2＇-bpy = 2,2＇- bipyridine, C8H3NO6 = 4-nitrophthalate） has been synthesized by a hydrothermal reaction and characterized by X-ray single-crystal...A new binuclear complex [Ni2（2,2＇-bpy）2（C8H3NO6）2（H2O）4] 1 （2,2＇-bpy = 2,2＇- bipyridine, C8H3NO6 = 4-nitrophthalate） has been synthesized by a hydrothermal reaction and characterized by X-ray single-crystal diffraction analysis. The complex crystallizes in triclinic, space group P1 with a = 7.206（2）, b = 10.337（4）, c = 12.480（4） , α = 89.887（11）, β = 77.033（9）, γ = 78.349（6）o, V = 886.3（5） 3, Z = 1, C36H30Ni2N6O16, Mr = 920.08, Dc = 1.724 g cm-3, F（000） = 472, μ = 1.152 mm-1, the final R = 0.0458 and wR = 0.1163 for 3372 observed reflections with I 2σ（Ⅰ）. The two Ni（Ⅱ） ions are bridged by two 4-nitrophthalates both in a bis-monodentate mode. Magnetic measurements reveal that the intramolecular exchange couplings in the dimer are ferromagnetic with 2J/k = 2.32 K, D =-1.44 K and g = 2.18.展开更多
Two new Ni（ Ⅱ） coordination polymers, {[Ni（tbip）（bipy）（H2O）]-0.5H2O}n 1 and [Ni（tbip）（phen）（H2O）]n 2 （Hatbip = 5-tert-butyl isophthalic acid, bipy = 2,2＇-bipyridine, phen = 1,10-phenanthroline）, have...Two new Ni（ Ⅱ） coordination polymers, {[Ni（tbip）（bipy）（H2O）]-0.5H2O}n 1 and [Ni（tbip）（phen）（H2O）]n 2 （Hatbip = 5-tert-butyl isophthalic acid, bipy = 2,2＇-bipyridine, phen = 1,10-phenanthroline）, have been synthesized under hydrothermal conditions and characterized by elemental analysis, X-ray diffraction, and IR spectroscopy. In the two polymers, H2tbip acts as a tridentate ligand. Compound 1 has a tbip bridged 1-D linear chain which is extended by hydrogen bonds into a 1-D double chain, while compound 2 exhibits a 1-D zigzag chain.展开更多
A new kind of Schiff base HL（HL= 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-Leucine methyl ester） and complexes Ni L′_2·0.75C_2H_5OH·0.25H_2O,Cu L′′2（L′ = 1-phenyl-3-methyl-4-（p-meth...A new kind of Schiff base HL（HL= 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-Leucine methyl ester） and complexes Ni L′_2·0.75C_2H_5OH·0.25H_2O,Cu L′′2（L′ = 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-leucine ethyl,L′′ = 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-leucine） have been synthesized and structurally determined by X-ray diffraction. For HL： crystal structure determination indicates that there are two independent HLs with different conformations in one asymmetric unit. For complex 1： the Ni（Ⅱ） ion is six-coordinated by two carbonyl oxygen atoms from pyrazolone ring,two nitrogen atoms from different HL′ and two oxygen atoms from L-Leucine ethyl ester to form a distorted octahedral geometry. For complex 2： the Cu（Ⅱ） ion is four-coordinated by one carbonyl oxygen atom from the pyrazolone ring,one nitrogen atom from HL′′,and two different carboxylic oxygen atoms from L-leucine with the same conformation to form a distorted quadrilateral geometry.展开更多
A new complex [Cu（L）（1,10-phen）]n （1, L = N-3-pyridine sulfonyl amino acid） has been synthesized and characterized by IR, elemental analysis and X-ray diffraction analysis, and its crystal belongs to monoclinic,...A new complex [Cu（L）（1,10-phen）]n （1, L = N-3-pyridine sulfonyl amino acid） has been synthesized and characterized by IR, elemental analysis and X-ray diffraction analysis, and its crystal belongs to monoclinic, space group P2Jc with a = 11.481 （2）, b = 1 8.094（4）, c = 8.5198（17） ]°, β= 102.26（3）°, V = 1729.5（6） ,/k3, Z = 4, Dc = 1.759 g/cm3, F（000） = 932, p = 1.422 mm-1, R = 0.0368 and wR = 0.0893. In 1, the Cu（ll） ion adopts a slightly distorted five-coordinated square pyramidal geometry. The L2- ligand adopts O of the carboxyl bridging adjacent Cu（Ⅱ）units to form an infinite chain structure along the c axis. Also, π-π stacking interactions between the adjacent chains expanded the 1-D structures into a 3-D supramolecular structure.展开更多
The reaction of 4-hydroxybenzoic acid (H2L),4, 4-diaminodiphenylmethane (DADPM) and Cd(NO3)2?H2O in methane/water gave rise to a seven-coordinate Cd(Ⅱ) complex [Cd2(HL)4(H2O)6]?H2O which has been characterized by sin...The reaction of 4-hydroxybenzoic acid (H2L),4, 4-diaminodiphenylmethane (DADPM) and Cd(NO3)2?H2O in methane/water gave rise to a seven-coordinate Cd(Ⅱ) complex [Cd2(HL)4(H2O)6]?H2O which has been characterized by single-crystal X-ray diffraction. The complex crystallizes in the orthorhombic system, space group Pna21 with unit cell parameters: a = 10.3352(3), b = 12.0481(3), c = 28.2016(1) ? V = 3511.65(13) 3, Z = 4, C28H36Cd2O20, Mr = 917.37, Dc = 1.735 g/cm3, F(000) = 1840, (MoK? = 1.29mm-1. The final R and wR are 0.0536 and 0.1086 for 4898 observed reflections with I ≥ 4(I). The Cd(Ⅱ) is seven-coordinated in a distorted pentagonal bipyramidal geometry. The inter-molecular hydrogen bonds lead to the formation of a two-dimensional layer structure.展开更多
A new cobalt(Ⅱ) complex [Co(-phth)(imi)2]n (phth = o-phthalato, imi = imidazole) has been synthesized by the reaction of CoCl2 with disodium o-phthalate and imidazole. The crystal structure of the compound has been d...A new cobalt(Ⅱ) complex [Co(-phth)(imi)2]n (phth = o-phthalato, imi = imidazole) has been synthesized by the reaction of CoCl2 with disodium o-phthalate and imidazole. The crystal structure of the compound has been determined by single-crystal X-ray diffraction. The crystal is of monoclinic system, space group Pn with a = 8.405(1), b = 9.995(1), c = 9.996(2) ? b = 104.479(2), V = 813.0(2) ?, Dc = 1.467 g/cm3, C14H12N4O4Co, Mr = 359.21, F(000) = 366, m = 1.079 mm-1, Z = 2, R = 0.0483 and wR = 0.1209 for 1583 observed reflections (I > 2s(I)). In the title complex, the Co(Ⅱ) ions are bridged by o-phthalate ligands in a bidentate mode, producing a zigzag infinite chain structure. Each four-coordinated cobalt(Ⅱ) center was coordinated by two oxygen atoms and two nitrogen atoms to give a distorted tetrahedral geometry. The chains are linked by hydrogen bonds between oxygen atoms belonging to carboxylate groups and hydrogen atoms of imidazole molecules, forming an unusual two-dimensional coordination polymer.展开更多
The title complex [NiL]·H2O（C20H24N2NiO5,L = paeonol-ehylenediamine） was synthesized by the hydrothermal method and characterized by IR,cyclic voltammetry and X-ray single-crystal diffraction.The complex belong...The title complex [NiL]·H2O（C20H24N2NiO5,L = paeonol-ehylenediamine） was synthesized by the hydrothermal method and characterized by IR,cyclic voltammetry and X-ray single-crystal diffraction.The complex belongs to the monoclinic system,space group P21/c with a=13.4361（13）,b=7.3290（10）,c=20.981（2）,β=109.244°,V=1950.6（4）3,Z=4,F（000）=904,Dc=1.468 g/cm3,μ（MoKα）=1.029 mm-1,the final R=0.0588 and wR=0.1577.The complex exhibits antimicrobial activities（antimicrobial activities against Staphylococcus aureus and Escherichia codi） by agar diffusion measurement.展开更多
One novel binuclear Co（Ⅱ） coordination polymer ∞ [Co2（4,4＇-bpy）2（L）4] （1, bpy = bipyridine, HL = 2-fluorbenzoic acid） has been hydrothermally synthesized and structurally characterized by elemental analysis...One novel binuclear Co（Ⅱ） coordination polymer ∞ [Co2（4,4＇-bpy）2（L）4] （1, bpy = bipyridine, HL = 2-fluorbenzoic acid） has been hydrothermally synthesized and structurally characterized by elemental analysis, IR and X-ray single-crystal diffraction. Complex 1 crystallizes in the monoclinic system, space group P21/c with a = 11.163（2）, b = 21.943（4）, c = 9.6381（19） A, β = 113.92（3）°, V= 2158.2（7） A3, Z= 4, Dc = 1.518 g/cm^3, Mr = 493.31, F（000） =1004, R = 0.0303 and wR = 0.0808 for 3614 observed reflections （I〉 2σ（I））. Complex I exhibits a 3D Schlafli symbol （4.62）（4.66.83） topological framework, and the magnetic characterization shows weak antiferromagnetic coupling exchange between two Co ions.展开更多
A new cadmium（Ⅱ） coordination polymer,namely,[KCd2（edta）I]n（1,H4edta = ethylenediaminetetraacetic acid）,has been prepared and structurally characterized by single-crystal X-ray diffraction.Crystallographic data...A new cadmium（Ⅱ） coordination polymer,namely,[KCd2（edta）I]n（1,H4edta = ethylenediaminetetraacetic acid）,has been prepared and structurally characterized by single-crystal X-ray diffraction.Crystallographic data for 1：C10H12Cd2IKN2O8,Mr = 679.02,monoclinic,space group P21/n,a = 9.870（5）,b = 8.989（4）,c = 19.082（10） ,β = 104.581（10）o,V = 1638.5（13） 3,Z = 4,Dc = 2.753 g/cm3,μ = 4.776 mm-1,F（000） = 1272,the final R = 0.0473 and wR = 0.1311 for 2846 observed reflections with I 〉 2σ（I）.Polymer 1 features a 2-D layered structure,in which each edta4-ligand chelates/bridges five adjacent six-/seven-coordinated Cd（Ⅱ） centers with all ten donors（eight oxygen and two nitrogen） involved with coordination.Additional iodide I-ions as counterions are bound to the Cd（Ⅱ） centers in a terminal mode and the potassium K＋ ions are located in the layers and surrounded by O and I atoms from neighboring environment.The thermal stability of 1 has been discussed.展开更多
The 1-D chain coordination complex of {[Mn2（HCAM）3（H2bipy）]·5H2O}n （H3CAM = 4-hydroxypyridine-2,6-dicarboxylic acid, bipy = 4,4＇-bipyridine） has been synthesized by the reaction of 4-hydroxypyridine-2,6-di...The 1-D chain coordination complex of {[Mn2（HCAM）3（H2bipy）]·5H2O}n （H3CAM = 4-hydroxypyridine-2,6-dicarboxylic acid, bipy = 4,4＇-bipyridine） has been synthesized by the reaction of 4-hydroxypyridine-2,6-dicarboxylic acid, 4,4＇-bipyridine and manganese carbonate under hydrothermal conditions, and its crystal structure was determined by X-ray diffraction method The crystal belongs to the monoclinic system, space group P21/n with a = 10.110（2）, b = 20.159（4）, c = 17.861（4）A,β = 99.67（3）°, V = 3.5884（12） nm3, Mr= 901.47, Z = 4, Dc= 1.669 g.cm^-3, μ= 0.798 mm^-1, F（000） = 1840, the final R = 0.0713 and ωR = 0.1853. The complex forms a 1-D chain bridged by HCAM, protonated 4,4-bipyridines link the 1-D chains to construct 2-D networks via N-H...O hydrogen bonds, and networks are further extended via π-π stacking and hydrogen bonds into 3-D supramolecular framework.展开更多
A novel coordination polymer, [Cd2Cl4（bpme）]n·n（H2O） （1, bpme=2,5-bis（be-nzoimidazol-2-yl）pyrazine）, has been synthesized and its crystal structure was determined by single-crystal X-ray diffraction. The ...A novel coordination polymer, [Cd2Cl4（bpme）]n·n（H2O） （1, bpme=2,5-bis（be-nzoimidazol-2-yl）pyrazine）, has been synthesized and its crystal structure was determined by single-crystal X-ray diffraction. The crystal of the complex belongs to the triclinic system, space group P , with a=7.0737（9）, b=8.7886（11）, c=9.4561（12） , α=105.3580（10）, β=94.981（2）, γ=96.879（2）°, V=558.46（12） 3, Mr=714.97, Z=1, F（000）=346, Dc=2.126 g/cm3, μ=2.412 mm-1, T=296（2） K, S=1.057, R=0.0533 and wR=0.1480. According to the structural analysis, the Cd（Ⅱ） ion adopts a slightly distorted six-coordinated octahedral geometry. The Cd（Ⅱ） atoms are bridged by four Cl atoms along the a direction, forming infinite straight chains which are further constructed to generate 2D network layer structures through the μ4-N bpme ligand in the b direction, and such 2D network layer structures finally form a novel three-dimensional infinite supramolecular framework through weak π-π stacking between two network layers and hydrogen bonds.展开更多
Three novel complexes [Cu（L1）2（H2O）2] （1）, [Ni（L1）2（H2O）2]·（H2O）4（2,HL1=5-methyl-1-（4-methylphenyl）-1,2,3-triazole-4-carboxylic acid） and [Ni2 （HL2）2（CH3OH）6]·（CH3OH）2（3,H3L2=1,2,3-tri...Three novel complexes [Cu（L1）2（H2O）2] （1）, [Ni（L1）2（H2O）2]·（H2O）4（2,HL1=5-methyl-1-（4-methylphenyl）-1,2,3-triazole-4-carboxylic acid） and [Ni2 （HL2）2（CH3OH）6]·（CH3OH）2（3,H3L2=1,2,3-triazole-4,5-dicarboxylic acid） were synthesized and characterized by elemental analysis, IR and X-ray diffraction. Complexes 1 and 2 are mononuclear structures, and are assembled into a two-dimensional sheet by C（7） H（7）···O（3） weak interactions or hydrogen-bonding interaction. Complex 3 is a centrosymmetric dinuclear structure, and is assembled into a three-dimensional supramolecular structure by hydrogen-bonding interaction.展开更多
文摘Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmethyl)butane(bib)by a hydrothermal method,respectively.X⁃ray crystallography reveals a 2D network constructed by six⁃coordinated Ni(Ⅱ)centers,bib,and Hpdc2-ligands in complex 1,while a 2D network is built by Ni(Ⅱ)and bib ligands in 2.Furthermore,the quantum⁃chemical calculations have been performed on‘molecular fragments’extracted from the crystal structure of 1 using the PBE0/LANL2DZ method in Gaussian 16 and the VASP program.CCDC:2343794,1;2343798,2.
基金the financial support from the National Natural Science Foundation of China(21171135)Hubei Provincial Science & Technology Department(2011BFA020)Hubei Independent Innovation Base(HBIR07)
文摘A polymer, [NiL（bipy）·2H2O]n（1, bipy = 4,4ˊ-bipyridine）, has been acquired by the reaction of Ni（OAc）2·4H2O with N,Nˊ-bis（2-hydroxyl-5-fluorobenzyl）-2-hydrxylpropane dii- mine in the presence of 4,4ˊ-bipyridine. X-ray crystallographic analysis shows that it is comprised of a mononuclear Ni（Ⅱ） complex [NiL] linked by 4,4ˊ-bipyridine. Its crystal crystallizes in the orthorhombic system, space group C2/c with a = 22.595（3）, b = 18.395（2）, c = 15.434（2） , V = 6155（1）3, Dc = 1.259 g/cm-3, Z = 8, Mr = 583.23, F（000） = 2416.0, μ（MoKa） = 0.681 mm-1, S = 1.049, R = 0.0512 and wR = 0.1108 for 6032 observed reflections（I 〉 2σ（I））. There are water hexamers in the complex. A weak overall ferromagnetic behavior has been evaluated by Curie-Weiss rule and by the formula of alternating ferro-ferromagnetic coupling in one-dimensional Ni（Ⅱ） chain, which gives g = 2.005（1） and J1 = 0.31（3） cm-1.
基金Supported by the National Natural Science Foundation of China(21371052)
文摘One new coordination polymer, [Ni（m-bix）（m-BDC）]（1, m-bix = 1,3-bis（imidazol-1-ylmethyl）benzene, m-BDC = 1,3-benzenedicarboxylic acids）, has been hydrothermally synthesized and structurally characterized by elemental analysis, IR, TGA and X-ray single-crystal diffraction. The green block crystal of complex 1（C22H18N4Ni O4） belongs to monoclinic system, space group P21/c with a = 10.0418（3）, b = 23.8651（6）, c = 8.7872（2） A, β = 112.333（3）°, V = 1947.88（9）A3, Z = 4, Dc = 1.572 g/cm^3, Mr = 461.11, F（000） = 952, R = 0.0335 and w R = 0.0683 for 2827 observed reflections（I 〉 2σ（I））. Complex 1 exhibits a novel 6-connected 3D sxd type topological framework. The magnetic characterization of complex 1 shows antiferromagnetic coupling exchange.
基金Supported by the National Natural Science Foundation of China(21371052)the Scientific Research Fund of Heilongjiang Provincial Education Department(12531512)
文摘Two cobalt coordination polymers with the same 2D structure have been hydrothermally synthesized based on two bifunctional ligands with tetrazole and phosphonate（phosphonic acid） groups,namely,diethyl 4-（2H-1,2,3,4-tetrazol-5-yl） benzylphosphonate（C_2H_5-L1） and 4-（2H-1,2,3,4-tetrazol-5-yl）benzylphosphonic acid（H_2L2）. The structures of the two complexes are characterized by elemental analysis,IR,TGA and X-ray single-crystal/powder diffraction. The pink block crystals of complex [Co（L1）（H_2O）]·H_2O（1） belong to the monoclinic system,space group C2/m with a = 20.8390（11）,b = 7.2695（3）,c = 10.0156（6） A,β = 109.773（7）°,V = 1427.80（13） A^3,Z = 4,D_c = 1.680 mg/cm^-3,M_r = 361.16,F（000） = 740,R = 0.0316 and wR = 0.0826 for 1702 observed reflections（I 〉 2σ（I））. The purple block crystals of complex [Co（L2）（H_2O）]·2H_2O（2） also belong to the monoclinic system,space group C2/c with a = 25.5382（16）,b = 7.3844（3）,c = 15.1925（11） A,β = 124.238（9）°,V = 2368.6（2） A^3,Z = 8,D_c = 1.969 mg/cm^-3,M_r = 351.12,F（000） = 1432,R = 0.0475,wR = 0.1617 for 2088 observed reflections（I 〉 2σ（I））. Both the nitrogen atoms of tetrazole group and oxygen atoms of phosphonate（phosphonic acid） groups in the ligands coordinated with the metal cobalt. The magnetic property of complex 1 is also investigated.
基金supported by the Natural Science Foundation of Henan Province (Nos. 092102310075 and 0511022600)
文摘A Ni（Ⅱ） supramolecular complex,[Ni 2 （btec）（3py） 2 （H 2 O） 8 ]（H 2 O） 4 （1）,has been synthesized by Ni（ClO 4） 2 ·6H 2 O,benzene-1,2,4,5-tetracarboxylic acid （H 4 btec） and terminal ligand 3-hydroxypyridine （3py） in aqueous solution.The title compound crystallizes in triclinic system,space group P1,with a=8.5637（12）,b=9.4138（13）,c=10.3611（14）,α=67.9540（10）,β=85.1740（10）,γ=76.9890（10）°,V=754.33（18） 3,Z=2,M r=386.96,D c=1.704 Mg/m 3,μ=1.345 mm-1,F（000）=402,the final R=0.0222 and wR=0.0563 for 2675 observed reflections with I 2σ（Ⅰ）.The adjacent discrete molecules are further self-assembled by intermolecular π-π and O-H···O hydrogen bonding interactions to construct a 3D supramolecular framework.Magnetic measurement shows weak ferromagnetic interaction in the range of 2～300 K.
基金supported by the Science and Technology Foundation of Guizhou Province (No.[2008]2216)
文摘A new binuclear complex [Ni2（2,2＇-bpy）2（C8H3NO6）2（H2O）4] 1 （2,2＇-bpy = 2,2＇- bipyridine, C8H3NO6 = 4-nitrophthalate） has been synthesized by a hydrothermal reaction and characterized by X-ray single-crystal diffraction analysis. The complex crystallizes in triclinic, space group P1 with a = 7.206（2）, b = 10.337（4）, c = 12.480（4） , α = 89.887（11）, β = 77.033（9）, γ = 78.349（6）o, V = 886.3（5） 3, Z = 1, C36H30Ni2N6O16, Mr = 920.08, Dc = 1.724 g cm-3, F（000） = 472, μ = 1.152 mm-1, the final R = 0.0458 and wR = 0.1163 for 3372 observed reflections with I 2σ（Ⅰ）. The two Ni（Ⅱ） ions are bridged by two 4-nitrophthalates both in a bis-monodentate mode. Magnetic measurements reveal that the intramolecular exchange couplings in the dimer are ferromagnetic with 2J/k = 2.32 K, D =-1.44 K and g = 2.18.
基金supported by the National Natural Science Foundation of China (Nos.20771026 and 20771054)the Henan Tackle Key Problem of Science and Technology (Nos.072102270030 and 072102270034)the Foundation of Education Committee of Henan Province (2006150017 and 2008A150018)
文摘Two new Ni（ Ⅱ） coordination polymers, {[Ni（tbip）（bipy）（H2O）]-0.5H2O}n 1 and [Ni（tbip）（phen）（H2O）]n 2 （Hatbip = 5-tert-butyl isophthalic acid, bipy = 2,2＇-bipyridine, phen = 1,10-phenanthroline）, have been synthesized under hydrothermal conditions and characterized by elemental analysis, X-ray diffraction, and IR spectroscopy. In the two polymers, H2tbip acts as a tridentate ligand. Compound 1 has a tbip bridged 1-D linear chain which is extended by hydrogen bonds into a 1-D double chain, while compound 2 exhibits a 1-D zigzag chain.
文摘A new kind of Schiff base HL（HL= 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-Leucine methyl ester） and complexes Ni L′_2·0.75C_2H_5OH·0.25H_2O,Cu L′′2（L′ = 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-leucine ethyl,L′′ = 1-phenyl-3-methyl-4-（p-methylbenzoyl）-5-pyrazolone with L-leucine） have been synthesized and structurally determined by X-ray diffraction. For HL： crystal structure determination indicates that there are two independent HLs with different conformations in one asymmetric unit. For complex 1： the Ni（Ⅱ） ion is six-coordinated by two carbonyl oxygen atoms from pyrazolone ring,two nitrogen atoms from different HL′ and two oxygen atoms from L-Leucine ethyl ester to form a distorted octahedral geometry. For complex 2： the Cu（Ⅱ） ion is four-coordinated by one carbonyl oxygen atom from the pyrazolone ring,one nitrogen atom from HL′′,and two different carboxylic oxygen atoms from L-leucine with the same conformation to form a distorted quadrilateral geometry.
基金supported by Key Laboratory for the Chemistry and Molecular Engineering of Medicinal Resources(Guangxi Normal University),Ministry of Education of China(No.CMEMR2011-13)the Scientific research and technological development project of Guilin(No.20110330)
文摘A new complex [Cu（L）（1,10-phen）]n （1, L = N-3-pyridine sulfonyl amino acid） has been synthesized and characterized by IR, elemental analysis and X-ray diffraction analysis, and its crystal belongs to monoclinic, space group P2Jc with a = 11.481 （2）, b = 1 8.094（4）, c = 8.5198（17） ]°, β= 102.26（3）°, V = 1729.5（6） ,/k3, Z = 4, Dc = 1.759 g/cm3, F（000） = 932, p = 1.422 mm-1, R = 0.0368 and wR = 0.0893. In 1, the Cu（ll） ion adopts a slightly distorted five-coordinated square pyramidal geometry. The L2- ligand adopts O of the carboxyl bridging adjacent Cu（Ⅱ）units to form an infinite chain structure along the c axis. Also, π-π stacking interactions between the adjacent chains expanded the 1-D structures into a 3-D supramolecular structure.
基金This work was financially supported by the National Natural Science Foundation of China the Key Project of Chinese Academy of Sciences
文摘The reaction of 4-hydroxybenzoic acid (H2L),4, 4-diaminodiphenylmethane (DADPM) and Cd(NO3)2?H2O in methane/water gave rise to a seven-coordinate Cd(Ⅱ) complex [Cd2(HL)4(H2O)6]?H2O which has been characterized by single-crystal X-ray diffraction. The complex crystallizes in the orthorhombic system, space group Pna21 with unit cell parameters: a = 10.3352(3), b = 12.0481(3), c = 28.2016(1) ? V = 3511.65(13) 3, Z = 4, C28H36Cd2O20, Mr = 917.37, Dc = 1.735 g/cm3, F(000) = 1840, (MoK? = 1.29mm-1. The final R and wR are 0.0536 and 0.1086 for 4898 observed reflections with I ≥ 4(I). The Cd(Ⅱ) is seven-coordinated in a distorted pentagonal bipyramidal geometry. The inter-molecular hydrogen bonds lead to the formation of a two-dimensional layer structure.
基金Supported by the National Natural Science Foundation of China (29872037)the Natural Science Foundation of Fujian province (C0120002)
文摘A new cobalt(Ⅱ) complex [Co(-phth)(imi)2]n (phth = o-phthalato, imi = imidazole) has been synthesized by the reaction of CoCl2 with disodium o-phthalate and imidazole. The crystal structure of the compound has been determined by single-crystal X-ray diffraction. The crystal is of monoclinic system, space group Pn with a = 8.405(1), b = 9.995(1), c = 9.996(2) ? b = 104.479(2), V = 813.0(2) ?, Dc = 1.467 g/cm3, C14H12N4O4Co, Mr = 359.21, F(000) = 366, m = 1.079 mm-1, Z = 2, R = 0.0483 and wR = 0.1209 for 1583 observed reflections (I > 2s(I)). In the title complex, the Co(Ⅱ) ions are bridged by o-phthalate ligands in a bidentate mode, producing a zigzag infinite chain structure. Each four-coordinated cobalt(Ⅱ) center was coordinated by two oxygen atoms and two nitrogen atoms to give a distorted tetrahedral geometry. The chains are linked by hydrogen bonds between oxygen atoms belonging to carboxylate groups and hydrogen atoms of imidazole molecules, forming an unusual two-dimensional coordination polymer.
基金supported by the National Natural Science Foundation of China(No.21973086,No.22203083)the Ministry of Science and Technology of China(No.2021YFA1200103)the Fundamental Research Funds for the Central Universities(No.WK2060000018)。
基金Supported by the Key Science Natural Fund of Jiangsu Province (No 07KJA15011)
文摘The title complex [NiL]·H2O（C20H24N2NiO5,L = paeonol-ehylenediamine） was synthesized by the hydrothermal method and characterized by IR,cyclic voltammetry and X-ray single-crystal diffraction.The complex belongs to the monoclinic system,space group P21/c with a=13.4361（13）,b=7.3290（10）,c=20.981（2）,β=109.244°,V=1950.6（4）3,Z=4,F（000）=904,Dc=1.468 g/cm3,μ（MoKα）=1.029 mm-1,the final R=0.0588 and wR=0.1577.The complex exhibits antimicrobial activities（antimicrobial activities against Staphylococcus aureus and Escherichia codi） by agar diffusion measurement.
基金supported by the National Natural Science Foundation of China(51343003)the Scientific Research Projects of Zhejiang Provincial Education Department(Y201224707)
文摘One novel binuclear Co（Ⅱ） coordination polymer ∞ [Co2（4,4＇-bpy）2（L）4] （1, bpy = bipyridine, HL = 2-fluorbenzoic acid） has been hydrothermally synthesized and structurally characterized by elemental analysis, IR and X-ray single-crystal diffraction. Complex 1 crystallizes in the monoclinic system, space group P21/c with a = 11.163（2）, b = 21.943（4）, c = 9.6381（19） A, β = 113.92（3）°, V= 2158.2（7） A3, Z= 4, Dc = 1.518 g/cm^3, Mr = 493.31, F（000） =1004, R = 0.0303 and wR = 0.0808 for 3614 observed reflections （I〉 2σ（I））. Complex I exhibits a 3D Schlafli symbol （4.62）（4.66.83） topological framework, and the magnetic characterization shows weak antiferromagnetic coupling exchange between two Co ions.
基金Financially supported by Fujian Provincial Department of Education(JB10203)National Natural Science Foundation of China(20871115)
文摘A new cadmium（Ⅱ） coordination polymer,namely,[KCd2（edta）I]n（1,H4edta = ethylenediaminetetraacetic acid）,has been prepared and structurally characterized by single-crystal X-ray diffraction.Crystallographic data for 1：C10H12Cd2IKN2O8,Mr = 679.02,monoclinic,space group P21/n,a = 9.870（5）,b = 8.989（4）,c = 19.082（10） ,β = 104.581（10）o,V = 1638.5（13） 3,Z = 4,Dc = 2.753 g/cm3,μ = 4.776 mm-1,F（000） = 1272,the final R = 0.0473 and wR = 0.1311 for 2846 observed reflections with I 〉 2σ（I）.Polymer 1 features a 2-D layered structure,in which each edta4-ligand chelates/bridges five adjacent six-/seven-coordinated Cd（Ⅱ） centers with all ten donors（eight oxygen and two nitrogen） involved with coordination.Additional iodide I-ions as counterions are bound to the Cd（Ⅱ） centers in a terminal mode and the potassium K＋ ions are located in the layers and surrounded by O and I atoms from neighboring environment.The thermal stability of 1 has been discussed.
基金Supported by the National Natural Science Foundation of China (No.20671064)Doctor Foundation of Liaoning Province (No.20071016)
文摘The 1-D chain coordination complex of {[Mn2（HCAM）3（H2bipy）]·5H2O}n （H3CAM = 4-hydroxypyridine-2,6-dicarboxylic acid, bipy = 4,4＇-bipyridine） has been synthesized by the reaction of 4-hydroxypyridine-2,6-dicarboxylic acid, 4,4＇-bipyridine and manganese carbonate under hydrothermal conditions, and its crystal structure was determined by X-ray diffraction method The crystal belongs to the monoclinic system, space group P21/n with a = 10.110（2）, b = 20.159（4）, c = 17.861（4）A,β = 99.67（3）°, V = 3.5884（12） nm3, Mr= 901.47, Z = 4, Dc= 1.669 g.cm^-3, μ= 0.798 mm^-1, F（000） = 1840, the final R = 0.0713 and ωR = 0.1853. The complex forms a 1-D chain bridged by HCAM, protonated 4,4-bipyridines link the 1-D chains to construct 2-D networks via N-H...O hydrogen bonds, and networks are further extended via π-π stacking and hydrogen bonds into 3-D supramolecular framework.
基金supported by the Guangxi Natural Science Foundation (No. 2010GXNSFA013017, No. 2010GXNSFA013062, No. 0991293)the Science Research Foundation of Guangxi Normal University
文摘A novel coordination polymer, [Cd2Cl4（bpme）]n·n（H2O） （1, bpme=2,5-bis（be-nzoimidazol-2-yl）pyrazine）, has been synthesized and its crystal structure was determined by single-crystal X-ray diffraction. The crystal of the complex belongs to the triclinic system, space group P , with a=7.0737（9）, b=8.7886（11）, c=9.4561（12） , α=105.3580（10）, β=94.981（2）, γ=96.879（2）°, V=558.46（12） 3, Mr=714.97, Z=1, F（000）=346, Dc=2.126 g/cm3, μ=2.412 mm-1, T=296（2） K, S=1.057, R=0.0533 and wR=0.1480. According to the structural analysis, the Cd（Ⅱ） ion adopts a slightly distorted six-coordinated octahedral geometry. The Cd（Ⅱ） atoms are bridged by four Cl atoms along the a direction, forming infinite straight chains which are further constructed to generate 2D network layer structures through the μ4-N bpme ligand in the b direction, and such 2D network layer structures finally form a novel three-dimensional infinite supramolecular framework through weak π-π stacking between two network layers and hydrogen bonds.
基金Financially supported by the Natural Science Foundation of Xinjiang Province (No.2011211A009)the Open Project Program of Xinjiang Laboratory of Advanced Functional Materials (XJDX0902-2010-02)the Urumqi Science and Technology Project (No.H101133001)
文摘Three novel complexes [Cu（L1）2（H2O）2] （1）, [Ni（L1）2（H2O）2]·（H2O）4（2,HL1=5-methyl-1-（4-methylphenyl）-1,2,3-triazole-4-carboxylic acid） and [Ni2 （HL2）2（CH3OH）6]·（CH3OH）2（3,H3L2=1,2,3-triazole-4,5-dicarboxylic acid） were synthesized and characterized by elemental analysis, IR and X-ray diffraction. Complexes 1 and 2 are mononuclear structures, and are assembled into a two-dimensional sheet by C（7） H（7）···O（3） weak interactions or hydrogen-bonding interaction. Complex 3 is a centrosymmetric dinuclear structure, and is assembled into a three-dimensional supramolecular structure by hydrogen-bonding interaction.
