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1.
The complexes of [Cu(bpy)(H2O)(CBA)2]n 1 and [Cu(phen)(H2O)(CBA)2]·H2O 2 based on p-cyanobenzoic acid(HCBA) have been synthesized in aqueous ethanolic solution at room temperature. The single-crystal X-ray diffraction studies demonstrated that complex 1 crystallizes in orthorhombic and complex 2 is of triclinic system. The results indicate the complex 1 shows a 1D chain structure bridged by two carboxylic oxygen atoms from CBA–, and complex 2 is a mononuclear structure. Through intermolecular hydrogen bonding and π...π stacking interactions, the complexes are assembled into supramolecular structures. Complex 1 has been characterized by magnetic measurements. The magnetic measurement indicates that weak ferromagnetic interaction(zJ= 0.038(5)) between the Cu2+ ions is dominant in the structure. The IR spectrum and results of thermal and elemental analyses are also presented.  相似文献   

2.
王庆伦  廖代正  阎世平  姜宗慧  程鹏 《中国化学》2002,20(11):1249-1255
IntroductionMolecularmagnetismofpolynuclearcomplexesisofconsiderableinterestfordesigningnewmagneticmaterialsandforinvestigatingtherelationshipbetweenthestructureandtheroleofthepolymetallicactivesitesinbiologicalsystems.1 4 Journauxetal .5haverecentlyprop…  相似文献   

3.
The paper describes the crystal structures and magnetic properties of complexes of copper(II) hexafluoroacetate (Cu(hfac)2) with stable pyrazolesubstituted iminonitroxyl radicals containing the pyrazole substitutuent in the second position of the 2imidazoline cycle (L). A new group of [Cu(hfac)2]3(L)2 complexes is found, in which L performs a bidentatebridge function due to the coordination of the imine N atoms of the pyrazole and imidazoline cycles. It is shown that in the solid complexes there are Cu2+—N = C—N—O exchange routes with highenergy ferromagnetic interactions (60–100 cm-1).  相似文献   

4.
Two new transition metal complexes, [Ni(bipy)2Cl]·ClO4 (bipy = 2,2'-bipyridine) 1 and [Zn(bipy)2Cl]·BF4 2, have been synthesized and characterized by single-crystal X-ray diffraction analysis. Both 1 and 2 crystallize in monoclinic space group P21/n with Z = 4. For 1, a = 10.776(1), b = 12.067(1), c = 16.146(2)(A), β= 93.021(2)o, V = 2031.9(4)(A)3, Mr = 505.98, Dc = 1.654 g/cm3, μ = 1.255 mm-1, F(000) = 1032, the final R = 0.0406 and wR = 0.1002 for 3983 observed reflections with Ⅰ > 2σ(I). For 2, a = 10.758(4), b = 12.058(4), c = 16.135(5) (A), β = 104.57(1)o, V = 2025.7(12) (A)3, Mr = 500.00, Dc = 1.639 g/cm3, μ = 1.396 mm-1, F(000) = 1008, the final R = 0.0470 and wR = 0.1237 for 3759 observed reflections with Ⅰ > 2σ(I). The crystal structures of 1 and 2 are isostructural with very similar supramolecular structures. A one-dimen- sional zigzag double hydrogen-bonding-chain is generated by the intermolecular M-bipy …anion…bipy--M hydrogen bonding interactions between the chelating ligands of bipy and anion.  相似文献   

5.
《结构化学》2020,39(5):933-941
By adopting mixed-ligand strategy, two Co(Ⅱ) coordination polymers, [Co(phda)(itmb)(H_2O)_2]_n(1) and [Co(phda)(Hpytz)]_n(2)(H_2phda = 1,2-phenylenediacetate, itmb = 1-(imidazo-1-ly)-4-(1,2,4-triazol-1-yl methyl) benzene and Hpytz = 3,5-di(4-pyridyl)-1,2,4-triazolate), were hydrothermally synthesized and then characterized by elemental analysis, IR spectroscopy, thermogravimetric analysis(TGA), powder X-ray diffraction(PXRD) and single-crystal X-ray diffraction. The single-crystal X-ray diffraction reveals that two complexes feature carboxylato-bridged binuclear subunits extended further by the nitrogen-rich coligands to form different structures. Complex 1 containing phda-bridged binuclear cobalt is developed by itmb coligand to 1D double-stranded chain, whereas complex 2 exhibits 2D open bilayers, which result from the ribbon-like carboxylate chains pillared Hpytz coligands. In addition, the magnetic susceptibilities of both compounds were measured over the temperature range of 3~300 K, and the data were analyzed well using Mag Saki software. The best fitting parameters were κ = 0.98, λ =-100 cm~(-1), ? = 588 cm~(-1) and J = 0.6 cm~(-1) for complex 1 and κ = 0.86, λ =-110 cm~(-1), ? = 756.8 cm~(-1) and J =-1.25 cm~(-1) for complex 2. The results indicate the existence of weaker ferromagnetic interaction for complex 1 and antiferromagnetic interaction for complex 2 between the metal centers in the dinuclear metal units.  相似文献   

6.
The hydrothermal reaction of copper chloride dihydrate and 5,5-dimethyl-imi-dazolidine-2,4-dione with a mole ratio of 1:1 in acetonitrile resulted in the formation of a new acetate-bridged dinuelear copper complex, [C2H6ON]2[Cu2Cl2(μCH3COO)4]. Protonated aeetamide in enolic form and acetic acid were yielded by the hydrolysis of aeetonitrile under hydrothermal condition. The title complex (C12H24Cl2Cu2N2O10) was charactetized by X-ray single-crystal diffraction, IR spectrum, elemental and electrochemical analysis. It crystallizes in the monoclinie system, space group P21/c with a = 8.2980(14), b = 14.358(2), c = 12.0010(2) A,β= 130.620(3)°, V= 1085.3(2)A3, Dc = 1.696 g/am3, Mr = 554.31, Z = 2, F(000) = 564 and μ= 2.254 mm-1. The crystal structure consists of a tetraacetate-bridging dinulcear copper complex anion [Cu2Cl2(μ-CH3COO)4]2-, with the chlorine anions in the axial positions, and two protonated acetamide cations [C2H6ON]+, which were connected through hydrogen bonds to form a three-dimensional infinite network.  相似文献   

7.
Two new copper complexes based on 2-naphthoxyacetic acid ligand, namely [Cu(L)_2(CH_3CN)]_2(1) and [Cu(L)(1,10-phen)_2](2), where L = 2-naphthoxyacetic acid and 1,10-phen = 1,10-phenanthroline, were obtained by hydrothermal reaction and characterized by single-crystal X-ray diffraction. The binuclear complex 1 and mononuclear complex 2 belong to space group C2/c and P■, respectively. The binding properties of the two compounds with ct-DNA were investigated by UV-Vis and fluorescence spectra. The two compounds could bind with ct-DNA through interactions. Compound 2 displays stronger binding ability in the reaction with ct-DNA.  相似文献   

8.
IntroductionTheabilityofdithiocarbamate(dtc)bindingtometalshasbeenknownformanyyears .Itformschelateswithvirtu allyalltransitionmetals.1Thebidentateanionisalsowellknownasabridgebetweentwotransitionmetalcenters.2 Wa ter solubledialkyldithiocarbamatecomplexes…  相似文献   

9.
Two new compounds,1([Cu(IDB_)2]Cl_2·2CH_3CH_2OH·2H_2O(IDB = N,N-di(2-benzimidazolylmethyl)imine]) and 2([Cu(EDTB)]·2[C_6H_4(OH)COO]·6H_2O(EDTB = N,N,N',N'-tetrakis-[(2-benzimidazolyl)methyl]-1,2-ethanediamine]),have been synthesized and their crystal structures were determined by single-crystal X-ray diffraction. Crystal 1 belongs to the triclinic system,space group P1 with a = 9.565(2),b = 9.863(2),c = 10.252(3) ?,α = 81.915,β = 88.330,γ = 87.347°,V = 956.28(40) ?3,Z = 1,F(000) = 427,D_c = 1.419 g/cm3,Mr = 817.27 and μ(MoKα) = 0.764 mm~(-1). The final R indices(I 2σ(I)): R = 0.0505,wR = 0.1417; R indices(all data): R = 0.0591,wR = 0.1525. Crystal 2 is of triclinic system,space group P1 with a = 11.487(3),b = 13.396(4),c = 17.977(5) ?,α = 73.899(5),β = 86.629(5),γ = 65.018(4)°,V = 2403.8(12) ?3,Z = 2,F(000) = 1072,D3c = 1.417 g/cm,Mr = 1025.54,μ(MoKα) = 0.528 mm~(-1). The final R indices(I 2σ(I)): R = 0.0769,w R = 0.163 2; R indices(all data): R = 0.0769,wR = 0.1632. The two compounds exhibit mononuclear structures. The copper(Ⅱ) atom of crystal 1 is six-coordinated by four nitrogen atoms of benzimidazole groups and two amine nitrogen atoms from the ligand IDB to adopt a distorted octahedral coordination geometry. The copper(Ⅱ) atom of crystal 2 is six-coordinated by four nitrogen atoms of benzimidazole groups and two amine nitrogen atoms from the ligand EDTB to show a distorted octahedral coordination geometry. Particularly,the two compounds exhibit fluorescent properties at room temperature in ethanol.  相似文献   

10.
<正>Two new Cu(II) complexes have been synthesized with two different bidentate N_2O_2 donor Schiff base ligands HL_1 (2-((E)-(4-chlorophenylimino)methyl)-6-bromo-4-chlorophenol) and HL_2 (2-((E)-(2-chlorophenylimino)methyl)-6-bromo-4-chlorophenol), respectively. Both complexes 1 and 2 have been characterized by elemental analysis and single-crystal X-ray diffraction studies. Structural studies reveal that in both complexes the metal centers are four-coordinated with N_2O_2 donor set of Schiff base ligands. Complex 1 belongs to the tetragonal system, space group P4(3)2(1)2 with a = 10.2379(2), b = 10.2379(2), c = 24.9623(90) , V = 2616.41(12) ~3, Z = 4, D_c = 1.908 g/cm~3, μ(MoKα) = 4.3327 mm~(-1), F(000) = 1468, S = 0.999, the final R = 0.0345 and wR = 0.0835 for 3506 unique reflections (R_(int) = 0.0428) with 3249 observed ones (I > 2σ(I)). Complex 2 is of monoclinic system, space group P21/c with a = 11.064(3), b = 9.437(2), c = 13.277(4), β = 108.997(3)°, V = 1310.8(6) ~3 , Z = 2, D_c = 1.904 g/cm~3, μ(MoKα) = 4.319 mm~(-1), F(000) = 734, S = 0.997, the final R = 0.0282 and wR = 0.0619 for 3491 unique reflections (R_(int) = 0.0428) with 2777 observed ones (I > 2σ(I)). The units of the complex are linked via weak interactions, such as C-H…Br hydrogen bonds together with Cl…Cl and Cu…Cl interactions, leading to the formation of one-dimensional chain and two-dimensional network and stabilizing the crystal structure.  相似文献   

11.
A series of copper (Ⅱ) complexes with pyridine N- oxide- 2- ylmethylidened-ithiocarbazates as ligands were synthesized and characterized by IR spectra, electronic spectra and magnetic moments measurement at room temperature. Variable temperature magnetic susceptibilites (3-300K) of four complexs were measured and fitted with the Bleaney-Bowers dimer equation by considering the magnetic interaction between molecules. The fitting results show the existence of intramolecular ferromagnetic interactions and intermolecu-lar anti-ferromagnetic interactions in these copper( Ⅱ) complexes.  相似文献   

12.
《结构化学》2019,38(11)
Two novel manganese(Ⅱ) complexes, [Mn(pmadH_2)_2(3-Sb)]n(1) and {[Mn(pmadH2)(Hssal)(H_2O)]·2 H_2O}n(2)(pmadH_2= 2-pyrimidineamidoxime, 3-Sb = 3-sulfobenzoate dianion, H_3ssal = 5-sulfosalicylic acid), have been successfully obtained. The two complexes were characterized by single-crystal X-ray diffraction, powder X-ray diffraction, thermal gravimetric analysis, infrared spectra and elemental analysis. They are one-dimensional manganese polymer(1) and two-dimensional manganese complex(2), respectively. The values of χmT at 300 K of 1 and 2 are lower than the spin-only value for the non-interacting Mn(Ⅱ) ion(S = 5/2).  相似文献   

13.
Two Cu(Ⅱ) complexes of [Cu(2,6-DPC)(Hnta)(H_2O)]·H_2O(2,6-DPC = 2,6-pyridinedicarboxylic-carboxylate, Hnta = nicotinic acid) and [Cu_2(2,4-D)_4(Hnta)_2](2,4-D = 2,4-dichlorophenoxyacetic-carboxylate) were synthesized and successfully obtained as single crystals in this paper. The supramolecular structures of the complexes from zero to three dimensions and the weak intermolecular force in the crystal were analyzed. The single-crystal structures of the complexes were further analyzed by Hirshfeld surface analysis. The competition capacity of the complexes about calf thymus DNA(ct-DNA) was also analyzed by fluorescence spectroscopy. The ability of complexes to cleave the plasmid DNA(pBR322-DNA) was determined by gel electrophoresis assay. And at last, the complexes' cytotoxic activities were reviewed for four kinds of cancer cell lines(HeLa, MCF-7, HepG, SKOV-3), showing that the coordination polymer has anti-tumor activity and cytotoxicity.  相似文献   

14.
A dinuclear copper(Ⅱ) complex [Cu2(TATP)2(L-Leu)2(ClO4)2]2.2H2O was synthesized and characterized,where,TATP=1,4,8,9-tetraazatriphenylene,and L-Leu=L-leucinate,The complex was crystallized in the triclinic space group P1,with two independent molecules in a unit cell,Two Cu(Ⅱ) ions in each complex[Cu2(TATP)2(L-Leu)2(ClO4)2]molecule were found to be in different coordination geometries,i.e.,Cu2 or Cu4 of a distorted square-pyramidal geometry coordinated with two nitrogens of TATP,the amino nitrogen and one carboxylate oxygen of L-Leu and one oxygen of perchlorate,and Cul or Cu3 with an octahedral geometry coordinated with the above stated similar coordinated atoms,and another carboxylate oxygen of L-Leu coordinating to Cu2 or Cu4,The complex can interact with CT-DNA by an intercalative mode and cleave pBR322 DNA in the presence of ascorbate.  相似文献   

15.
A new copper(II) compound with imino nitroxide radicals [Cu(IM-MeImz)2]?(SCN)2 (IM-meImz =2-(5-methylimidazol-4-yl)-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl) has been synthesized and characterized structurally and magnetically. It crystallizes in monoclinic, space group P21/c with a = 9.3604(7), b = 10.3012(7), c = 16.6684(12) , β = 105.0290(10)o, V = 1552.25(19) 3, C24H34CuN10O2S2, Mr = 622.27, Z = 2, Dc = 1.331 g/cm3, μ(MoKα) = 0.876 mm-1, F(000) = 650, the final R = 0.0374 and wR = 0.1079. X-ray analysis demonstrates that the IM-MeImz ligand is coordinated to the copper(II) ion as an unusual didentate chelate with a κ2 N(MeImz),O(IM) mode in the complex. The square-planar coordination sites at Cu(II) are occupied by two O and two N atoms from the imino nitroxide radicals. The complex molecules are connected as a onedimensional polymer structure by intermolecular interactions. Magnetic measurements show that there are intramolecular antiferromagnetic interactions between the Cu(II) ion and radicals.  相似文献   

16.
IntroductionExchange coupledpolynuclearcopper(II)complex esareofspecialinterestduetotheirinvolvementinbio logicalprocessesandininorganicmaterials .1,2 Theinti materelationshipbetweenthespincouplingandthemolecularstructurehasfosteredtheemergenceofmolec ular…  相似文献   

17.
Abstract

3,5-Bis(aminomethyl)pyrazole (Hbampz) forms binuclear copper(II) complexes of the formula [Cu2(bampz)2X2] (X = CI, Br). The crystal structure of [Cu2(bampz)2Br2] has been determined by the X-ray method: formula = CuBrN4C5H9, monoclinic, space group P21/n, a = 9.214(1), b = 10.078(1), c = 8.775(1) Å, β = 97.33(1)°, V = 808.1 Å3. Two bampz? molecules combine with two copper(II) ions via the pyrazolate nitrogen and aminonitrogen atoms in the side chains affording an essentially planar N4 environment for each metal ion. The Cu-Cu separation is 3.947(5)A. The axial site of each copper is weakly coordinated by a bromide ion with a Cu-Br distance of 2.895(4) A. Cryomagnetic investigations over the temperature range 80-300 K revealed a significant antiferromagnetic interaction through the pyrazolate bridges. The exchange integrals (J) based on the Heisenberg model (H =—2J?1.?2) was estimated at—200.8 and—192.0 cm?1 for [Cu2(bampz)2Cl2] and [Cu2(bampz)2Br2], respectively.  相似文献   

18.
Crystal structures of [Co(MH)2(Thio)2][BF4] · H2O (I) and [Co(DH)2(NH3)2][BF4] (II), where MH is H3C–C(NOH)–C(NO)–H and DH is H3C–C(NOH)–C(NO)–CH3, were determined by X-ray diffraction. The crystals are monoclinic, space group C2/c, unit cell parameters (for I and II, respectively): a = 22.018(2) Å, b = 7.943(1) Å, c = 11.681(1) Å, = 92.68(1)° and a = 21.436(2) Å, b = 6.400(2) Å, c = 12.389(2) Å, = 113.13(1)°. In both cases, the Co(III) coordination polyhedron is a centrosymmetrical trans-octahedron, N4S2 for I and N6 for II. In the crystals of I and II, the complex cations and the outer-sphere [BF4] anions (and the crystal water molecules in I) form elaborate hydrogen bonding system.  相似文献   

19.
Two new transition metal complexes, [Ni(bipy)2Cl]·ClO4 (bipy = 2,2'-bipyridine) 1 and [Zn(bipy)2Cl]·BF4 2, have been synthesized and characterized by single-crystal X-ray diffraction analysis. Both 1 and 2 crystallize in monoclinic space group P21/n with Z = 4. For 1, a = 10.776(1), b = 12.067(1), c = 16.146(2) , β = 93.021(2)o, V = 2031.9(4) 3, Mr = 505.98, Dc = 1.654 g/cm3, μ = 1.255 mm–1, F(000) = 1032, the final R = 0.0406 and wR = 0.1002 for 3983 observed reflections with I > 2σ(I). For 2, a = 10.758(4), b = 12.058(4), c = 16.135(5) , β = 104.57(1)o, V = 2025.7(12) 3, Mr = 500.00, Dc = 1.639 g/cm3, μ = 1.396 mm–1, F(000) = 1008, the final R = 0.0470 and wR = 0.1237 for 3759 observed reflections with I > 2σ(I). The crystal structures of 1 and 2 are isostructural with very similar supramolecular structures. A one-dimen-sional zigzag double hydrogen-bonding-chain is generated by the intermolecular M-bipy ···anion···bipy- M hydrogen bonding interactions between the chelating ligands of bipy and anion.  相似文献   

20.
IntroductionPolynuclearmixed-metalcomplexescontainingbothtransitionandlanthanoidmetalionsareofspecialcurentinterestinrelation...  相似文献   

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