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1.
The hydrothermal reaction of Cd(OAc)2.H2O with 1,2-benzenedicarboxylate (1,2-BDC), imidazole and H2O resulted in the formation of a binuclear polymeric Cd( Ⅱ ) complex {[Cd2(1,2-BDC)2(Im)4].(H2O)}n which was then characterized by elemental analyses and single-crystal X-ray diffraction analysis. The crystal is of monoclinic system, space group P21/c with a = 14.6455(3), b = 9.3530(2), c = 23.7838(5)A, β= 106.6290(10)°, Cl12H104CdgN32O36, Mr = 3373.47, V = 3121.64(11)A^3, Dc = 1.795 g/cm^3, F(000) = 1672,μ= 1.428 cm^-1 and Z = 1. The final R = 0.0316 and wR = 0.0687 for 5045 reflections with I 〉 2σ(I). In the title complex, the two Cd( Ⅱ) ions are in different coordination environments with distorted octahedral and pengonal bipyramidal geometries, respectively. Two Cd polyhedra are linked together through one μ2-η^1:η^1 and one μ2-η^1:η^1 carboxylate groups from different 1,2-BDC ligands, giving rise to a binuclear Cd( Ⅱ ) cluster, and such clusters are connected by bridged 1,2-BDC ligands to form a 2-D structure along the c axis. The inter- and intermolecular hydrogen bonds further connect the 2-D structures into a 3-D supramolecular network.  相似文献   

2.
The hydrothermal reaction of Cd(OAc)2·H2O with 1,2-benzenedicarboxylate(1,2-BDC),imidazole and H2O resulted in the formation of a binuclear polymeric Cd(Ⅱ) complex {[Cd2(1,2-BDC)2(Im)4]·(H2O)}n which was then characterized by elemental analyses and single-crystal X-ray diffraction analysis.The crystal is of monoclinic system,space group P21/c with a = 14.6455(3),b = 9.3530(2),c = 23.7838(5) ,β = 106.6290(10)°,C112H104Cd8N32O36,Mr = 3373.47,V = 3121.64(11) 3,Dc = 1.795 g/cm3,F(000) = 1672,μ = 1.428 cm-1 and Z = 1.The final R = 0.0316 and wR = 0.0687 for 5045 reflections with I > 2σ(I).In the title complex,the two Cd(Ⅱ) ions are in different coordination environments with distorted octahedral and pengonal bipyramidal geometries,respectively.Two Cd polyhedra are linked together through one μ2-η1:η1 and one μ2-η1:η2 carboxylate groups from different 1,2-BDC ligands,giving rise to a binuclear Cd(Ⅱ) cluster,and such clusters are connected by bridged 1,2-BDC ligands to form a 2-D structure along the c axis.The inter-and intermolecular hydrogen bonds further connect the 2-D structures into a 3-D supramolecular network.  相似文献   

3.
汪快兵  王彦  陈友存 《结构化学》2009,28(5):590-596
A novel cadmium(Ⅱ) coordination polymer [Cd2(3-pa)4(4,4'-bpy)(H2O)].3.08H2O 1 has been synthesized by pyridine-3-carboxylate (3-pall) and CdO with exo-bidentate rigid dipyridyl ligand 4,4'-bipyridine (4,4'-bpy) by using a hydrothermal method, its structure was determined by single-crystal X-ray diffraction and its luminescent property was also documented. Complex 1 crystallizes in orthorhombic space group Pbcn with a = 21.4074(14), b = 27.1119(18), c = 12.3879(8) A, V = 7189.9(8) A3, Z = 8, C34H32.16Cd2N6O12.08, Mr= 942.85, Dc = 1.742 g/cms, p = 1.255 mm-1 and F(000) = 3766. The structure was solved by direct methods and refined to R = 0.0353 and wR = 0.0891 for 6278 observed reflections (I 〉 2σ(I)). The most prominent structural feature is the mutual interpenetration of two identical 3-D open frameworks via filling the large void space, which gives a 2-fold interpenetrating architecture during the self-assembly process.  相似文献   

4.
A novel organic-inorganic hybrid compound constructed from mixed ligands, Co3(SIP)2(bipy)4(H2O)6·6.5H2O (H3SIP = 5-sulfoisophthalic acid, bipy = 4,4′-bipyridyl), has been hydrothermally synthesized and characterized by IR, TGA and single-crystal X-ray diffraction. The crystal belongs to orthorhombic, space group P212121 with a = 11.395(2), b = 19.395(4), c = 30.675(6) A^°, Mr = 1513.05, V= 6779(2) A^°^3, Dc= 1.482 g/cm^3, F(000) = 3120, μ = 0.873 mm^-1, Z= 4, the final R = 0.0439 and wR = 0.119 for 13421 observed reflections with I〉 2σ(I). The structure of the compound presents a 3-D framework containing Co-bipy 1-D chain and 2-D bilayer motifs and carboxylate spacers, and the connection of 1-D chain and 2-D bilayer motifs by carboxylate ligand results in the final open framework with twofold interpenetration net. A probe reaction of the oxidation of benzaldehyde with H2O2 using the title compound as catalyst was carded out in a liquid-solid system, showing that the compound has high oxidative catalytic activity to the reaction.  相似文献   

5.
A cyclic bimetallic metal-organic complex [Zn(C)(H-fmpdc)(H2O)]2·2H2O (fmpdc = 4-(furan-2-yl)-2,6-dimethylpyridine-3,5-dicarboxylate) was synthesized and characterized by single-crystal X-ray analysis. The compound crystallizes in orthorhombic, space group Pbca with a = 12.905(2), b = 14.774(3), c = 16.833(3)A, V= 3029.4(10)A^3 Z = 4, Dc = 1.644 g/cm^3, F(000) = 1616, R = 0.0347 and wR = 0.0956 (I 〉 2σ(I)). There exist diverse supramolecular motifs (1-D, 2-D and 3-D) from distinct hydrogen bonds in the crystal structure of the title compound. The furanyl group has obvious contribution to the red-shift in the photoluminescent spectrum of the H2fmpdc ligand. The title compound 1 shows strong photoluminescence with emission maximum at 2 = 402 nm (λex.max = 367 nm).  相似文献   

6.
The title compound, [Cu2(C7H5O2)4(C2H6O)2], was synthesized by the reaction of benzoic acid, copper acetate and ethanol in an aqueous solution. Trypan blue dye exclusion method was used in experiment. X-ray single-crystal analysis has revealed that compound 1 (C32H32Cu2O10) crystallizes in the monoclinic system, space group C2/c, Mr = 703.66, a = 47.340(5), b = 6.6613(4), c = 22.028(2)A,β = 113.284(4)°, V = 6380.6(10) A^3, Z = 8, Dc= 1.465 g/cm^3, F(000) = 2896,μ = 1.388 mm^-11, the final R = 0.0515 and wR = 0.1172 for 5712 observed reflections with I 〉 2σ(I). X-ray crystal structure analysis suggests that compound [CH2(C7H5O2)4(C2H6O)2] has a binuclear structure with two Cu(II) atoms coordinated by four benzoate groups and two ethanol molecules. The crystal packing is stabilized by intermolecular O-H...O hydrogen bonds. The compound inhibits the proliferation of K562 cells (chronic myeloid leukemic cells) significantly and dose-dependently in 48 h, and IC50 of K562 is 17.3μg/mL by trypan blue dye exclusion method.  相似文献   

7.
A novel one-dimensional chain-like coordination polymer constructed from 3-nitrobenzene-1,2-dicarboxylic acid, [Cd2(C8H3NO6)2(H2O)4]n·2nH2O, has been synthesized and its structure was determined by X-ray crystallography method. The crystal belongs to monoclinic, space group P21/c with a = 6.1252(8), b = 20.706(3), c = 8.8067(11) (A), β = 95.608(2)°, V= 1111.6(2)(A)3, Mr =751.12, Dc = 2.244 g/cm3, F(000) = 736, μ = 2.011 mm-1, Z = 2, the final R = 0.0262 and wR = 0.0692for 2338 observed reflections with I > 2σ(I). The structure of the title compound presents a 1-D chain-like structure constructed by dimer units, [Cd2(CsH3NO6)2(H2O)4]n, through two carboxylate oxygen atoms. The fluorescence of the tifle compound has been also discussed in this paper.  相似文献   

8.
The title compound 1-(β-D-glucopyranosyl)-3-amino-5-methyl- 1H- 1,2,4-triazole was synthesized and characterized by IR, 1H-NMR and elemental analysis. Its single crystals of 2H2O adduct suitable for X-ray analysis were obtained by the slow evaporation of a H2O solution and its structure was determined by single-crystal X-ray diffraction. The crystal belongs to orthorhombic, space group P212121 with a = 7.7490(15), b = 10.424(2), c = 17.447(4) A^°, V = 1409.3(5) A^°^3, Z= 4, C9H20N4O7, Mr = 296.29, Dc = 1.396 g/cm^3,μ = 0.120 mm^-1, S = 1.007, F(000) = 632, R = 0.0686 and wR = 0.1560 for 1217 observed reflections with I 〉 20(I). The title molecules are linked through intermolecular hydrogen bonds to form two 1-D chain structures, and such adjacent chains are further linked by intermolecular hydrogen bonds and H2O bridges to form a 3-D supramolecular network structure. The preliminary bioassay results showed that the title compound exhibits fungicidal activities against Gibberella zeae and Colletotrichum orbiculare.  相似文献   

9.
One-pot solvothermal reaction of Iransition metal Znn salt with 4,4-bipyddyl (bpy) and 1,4-benzenediacrylic add (H2L) in the presence of Et3N generates a three-dimensional (3-D) supramolecular network with 1-D cation metal-organic coordination polymer, [Zn(H20)a(bpy)]-L 1, and structurally characterized by single-crystal X-ray diffraction, elemental analyses, IR spectroscopy, and photoluminescent property. The complex crystallizes in triclinic, space group P1 with a = 7.1291(2), b = 7.3784(3), c = 10.5042(3)A, α = 95.049(2), β = 102.162(2), 7 = 97.027(3)0, V= 532.38(3)A3, C22H24N2O8Zn, Mr = 509.82, De= 1.590 g/cm3, p(MoKa)= 1.207 ram-l, F(000) = 264, Z = 1,the finalR=O.0438and wR=O.lOll for 1589 observed reflections (I 〉 2σ(I)). In the crystal structure, the second building unit composed of [Zn(H2O)4].L constructs two distinct 2-D supramolecular sheets and a neutral 3-D architecture. The title compound 1 shows strong photoluminescence with emission maximum at 2 = 455 nm upon λex.max = 355 nm.  相似文献   

10.
Three new coordination networks based on a versatile and unsymmetric building block 3-(sulfonyl-glycine)benzoic acid (HAL) ligand and inorganic Co(Ⅱ) salt, [Co(HL)(bipy)2]. ClO4·1.5H2O (1), [Co3(L)2(H2O)6]·4H2O (2) and [Co(HL)(bpp)(H2O)2]·2H2O (3) (bipy = 2,2-bipyridine, bpp = 1,3-bi(4-pyridyl)propane), have been synthesized in aqueous media and structurally characterized by single-crystal X-ray diffraction. Reaction of Co salt with H3L afforded a neutral 1D alternating chain, which shows a 3-D supramolecular network through hydrogen bonds. When the auxiliary 2,2-bipyridine is used, a mononuclear unit is constructed; if using auxiliary ligand bpp, a neutral 1-D uniform chain is obtained and further extended into a 3-D supramolecular structure through versatile hydrogen bonds. The H3L ligand in 1 adopts a bidentate chelating coordination mode while that in 2 and 3 assumes a pentadentate bridging and a bis-monodentate bridging modes, respectively. This work and our previous work evidently demonstrate that the structures vary with altering the second ligands.  相似文献   

11.
Two new 1-naphthoate-based Pb(Ⅱ) complexes, [Pb(phen)(NA)2]n 1 and [Pb(bpp)(NA)2]n 2 (NA = 1-naphthoate, phen = 1,10-phenanthroline, and bpp = 1,3-bi(4-pyri- dyl)propane), were hydrothermally synthesized and structurally characterized. 1 is of monoclinic system, space group C2/c with a = 28.114(3), b = 10.9601(10), c = 8.6843(8) , β = 93.3760(10)°, V = 2671.3(4) 3, Dc = 1.814 g/cm3, Mr = 729.73, Z = 4, F(000) = 1416, μ = 6.360 mm-1, the final R = 0.0346 and wR = 0.0948 for 2184 observed reflections with I > 2σ(I). Complex 2 crystallizes in monoclinic, space group C2/c with a = 26.491(2), b = 8.7773(6), c = 27.893(2) , β = 113.3020(10)°, V = 5956.8(8)3, Dc = 1.668 g/cm3, Mr = 747.78, Z = 8, F(000) = 2928, μ = 5.706 mm-1, the final R = 0.0211 and wR = 0.0493 for 3677 observed reflections with I > 2σ(I). Both complexes present one-dimensional (1-D) zigzag chains extended by anionic NA linkers for 1 and bridged by neutral bpp connectors for 2, which are further aggregated into 2-D supramolecular networks by interchain π···π stacking interactions. In addition, the two solid-state complexes exhibit different strong emissions at room temperature, suggesting their potential applications as fluorescence materials.  相似文献   

12.
A new zinc coordination polymer, [Zn2(bpp)(tpa)2H2O] 1 (bpp=1,3-bis(4-pyridyl)-propane and tpa=terephthalate) has been hydrothermally synthesized and characterized by elemental analysis, IR and single-crystal X-ray diffraction. X-ray crystal structure analysis reveals that complex 1 crystallizes in monoclinic, space group P2/c with a=18.348(2), b=10.9080(14), c=13.7924(18), β=98.156(2)°, V=2732.5(6)3 , Z=4, C29H24N2O9Zn2 , Mr=675.24, Z=4, F(000)=1376, Dc=1.641 mg/m3 , μ=1.815 mm-1 , the final R=0.0443 and wR=0.0769 for 2715 observed reflections (I>2σ(I)). The title complex exhibits a two-dimensional (4, 4) sheet structure which is further stacked through face-to-face π-π interactions between the monodentately coordinated pyridine ring of bpp ligand and the phenyl ring of terephthalate ligand to form a 3-dimensional supramolecular structure. Thermogravimetric analyses show that the host framework of the complex is thermally stable up to ca. 400 ℃.  相似文献   

13.
Solvothermal reaction of aromatic terphenyl-2,5,2?,5?-tetracarboxylic acid (H4qptc) ligand and the transitional metal cation of NiII in the presence of 1,3-bi(4-pyri- dyl)propane (bpp) affords one new coordination polymer, [Ni(qptc)0.5(bpp)(H2O)]n (1). The structure has been determined by single-crystal X-ray diffraction analysis and further characterized by elemental analysis, IR, TGA, and magnetism. The qptc4- acts as a H-shaped ligand linking the NiII centers together to form a 2D polymeric [Ni(qptc)0.5]n layer consisting of alternately arranged left- and right-handed helical chains. Each 2D polymeric [Ni(qptc)0.5]n layer is further linked through the bridging bpp ligands, thus resulting in a unique (3,4)- connected network with the (62.8)(62. 84) topology. The crystal of 1 crystallizes in monoclinic, space group C2/c with a = 16.088(5), b = 14.913(5), c = 18.849(6) ?, β = 100.982(4), V = 4439(2) ?3, Z = 8, C24H21N2NiO5, Mr = 476.14, Dc = 1.425 g/cm3, F(000) = 1976 and μ(MoKα) = 0.912 mm-1. The final R = 0.0584 and wR = 0.1131 for 3894 observed reflections with I > 2σ(I) and R = 0.1224 and wR = 0.1279 for all data.  相似文献   

14.
Four platinum(II) cationic complexes were prepared with the mer-coordinating tridentate ligands 2,6-bis(N-pyrazolyl)pyridine (bpp) and 2,6-bis(3,5-dimethyl-N-pyrazolyl)pyridine (bdmpp): [Pt(bpp)Cl]Cl.H(2)O; [Pt(bdmpp)Cl]Cl.H(2)O; [Pt(bpp)(Ph)](PF(6)); [Pt(bdmpp)(Ph)](PF(6)). The complexes were characterized by (1)H NMR spectroscopy, elemental analysis, and mass spectrometry, and the structures of the bpp derivatives were determined by X-ray crystallography. [Pt(bpp)Cl]Cl.2H(2)O: monoclinic, P2(1)/n, a = 11.3218(5) A, b = 6.7716(3) A, c = 20.6501(6) A, beta = 105.883(2) degrees, V = 1522.73(11) A(3), Z = 4. The square planar cations stack in a head-to-tail fashion to form a linear chain structure with alternating Pt...Pt distances of 3.39 and 3.41 A. [Pt(bpp)(Ph)](PF(6)).CH(3)CN: triclinic, P, a = 8.3620(3) A, b = 10.7185(4) A, c = 13.4273(5) A, alpha = 96.057(1) degrees, beta = 104.175(1) degrees, gamma = 110.046(1) degrees, V = 1072.16(7) A(3), Z = 2. Cyclic voltammograms indicate all four complexes undergo irreversible reductions between -1.0 and -1.3 V vs Ag/AgCl (0.1 M TBAPF(6)/CH(3)CN), attributable to ligand- and/or metal-centered processes. By comparison to related 2,2':6',2' '-terpyridine complexes, the electrochemical and UV-visible absorption data are consistent with bpp being both a weaker sigma-donor and pi-acceptor than terpyridine. Solid samples of [Pt(bpp)(Ph)](PF(6)) at 77 K exhibit a remarkably intense, narrow emission centered at 655 nm, whereas the other three complexes exhibit only very weak emission.  相似文献   

15.
A copper(II) coordination polymer, [Cu3(HOA)2(bpp)4]n (1, H4OA = 3,3′,4,4′-oxidiphthalic acid, bpp = 1,3-bis(4-pyridyl) propane), has been hydrothermally synthesized. The crystal structure is of monoclinic, space group P21/c with a = 11.544(3), b = 16.129(4), c = 21.181(6) , β = 98.848(5), V = 3897.0(2) 3, C84O18N8H70Cu3, Mr = 1670.13, Z = 2, Dc = 1.423 g/cm3, F(000) = 1722, μ = 0.887 mm-1 , R = 0.0878 and wR = 0.2583 for 8496 observed reflections (I > 2σ(I)). Single-crystal X-ray structural analysis reveals that 1 is a three-dimensional (3D) framework based on a two-dimensional (2D) mesomeric layer of alternating left-and right-handed helical chains. The monodentate terminal and bidentate bridging bpp ligands in the same conformation are all encapsulated in the figure-of-eight-shaped channels, thus further stabilizing the whole three-dimen-sional framework.  相似文献   

16.
Tong ML  Wu YM  Ru J  Chen XM  Chang HC  Kitagawa S 《Inorganic chemistry》2002,41(19):4846-4848
A fascinating 3D pseudo-polyrotaxane architecture with 1D polymeric [Ag(bpp)](n) chains penetrating 2D (6,3) [Ag(2)(bpp)(2)(ox)](n) sheets and a 3D coordination network constructed with 2D infinite [Ag(ppa)](n) beta-sheetlike layers pillared by ox ligands (bpp = 1,3-bis(4-pyridyl)propane; ppa = N-(4-pyridinylmethyl)-4-pyridinecarboxamide; ox = oxalate) have been prepared by utilizing flexible pyridyl-type ligands and have been crystallographically characterized. Crystal data for 1: monoclinic, space group C2/c, a = 7.619(2) A, b = 19.781(4) A, c = 26.799(5) A, beta = 94.720(10) degrees, U = 4025.2(15) A(3), and Z = 4. Crystal data for 2: monoclinic, space group C2/c, a = 28.947(8) A, b = 8.617(3) A, c = 16.307(6) A, beta =121.07(1) degrees, U = 3484(2) A(3), and Z = 4.  相似文献   

17.
A new 1D coordination polymer [Co(bpp)3Cl2(H2O)2]n 1 (bpp = 1,3-bis(4-pyridyl)-propane) was synthesized and characterized by elemental analysis,IR spectrum and single-crystal X-ray diffraction. The crystal belongs to the orthorhombic system,space group Ibca with a = 16.569(9),b = 17.240(10),c = 27.087(16) ,V = 7738(8) 3,Z = 8,Dc = 1.306 g/cm3,Mr = 760.65,λ(MoKa) = 0.71073 ,μ = 0.623 mm1,F(000) = 3192,the final R = 0.0678 and wR = 0.2011. The Co(II) atom is coordinated in a slightly distorted octahedral CoN4Cl2 geometry by two Cl atoms in the axial positions,four N atoms from the two bridging bpp ligands and two pendant bpp ligands. The CoN4Cl2 octahedra are connected by the bridging bpp ligands to form a 1D neutral coordination polymer chain. The chains are linked by face-to-face π-π interactions between adjacent pendant bpp ligands to give rise to a 3D supramolecular architecture. The photoluminescent investigation indicates that the emission of 1 is attributed to ligand-centered emission. The variable-temperature magnetic susceptibility measurement shows weak antiferromagnetic behavior in the complex.  相似文献   

18.
A new coordination polymer associated with zinc ion,[Zn(Tda)(bpp)] n (1,H 2 tda=thiophene-2,5-dicarboxylic acid,bpp=1,3-bis(4-pyridyl)propane),was prepared under solvothermal conditions,and characterized by single-crystal X-ray diffraction,elemental analysis and IR spectra.The complex belongs to monoclinic,space group P2 1 /c with a=9.8799(4),b=12.0430(6),c=15.4269(9),β=95.424(5) o,V=1827.33(16) 3,Z=4,D c=1.577 g/cm 3,S=1.074,μ=1.486 mm-1,F(000)=888,M r=433.80,R=0.0359 and wR=0.0968 for 2685 observed reflections (I > 2σ(Ⅰ)).Complex 1 displays an interesting 2D lattice structure.In 1,four coordinated zinc ions were bridged by Tda and bpp ligands to generate a (4,4) two-dimensional layer.The thermogravimetric analysis,powder X-ray diffraction (XRD) and luminescent properties for 1 also have been explored.  相似文献   

19.
Self-assembly of Ag(Ⅰ) nitrate, 1,3-bis(4-pyridyl)propane (bpp) and phthalic acid monopotassium salt (KHphth) in CH3OH-H2O solution produced the title complex,{[Ag(bpp)]2(Hphth)(NO3)·(H2O)2}n, which was characterized by single-crystal X-ray diffraction,elemental analysis, IR spectrum, and photoluminescent spectrum. Single-crystal X-ray analysis revealed that the complex crystallizes in a monoclinic system, space group P21/c, with α =15.4174(5), b = 8.6398(2), c = 25.2466(8) (A), β = 91.072(1)°, V = 3362.34(17) (A)3, Z = 4,C34H37N5O9Ag2, Mr = 875.43, Dc = 1.729 g/cm3, μ = 1.228 mm-1, F(000) = 1768, the final R =0.0749 and wR = 0.1580 for 5754 reflections with I > 2σ(I). The Ag atom is coordinated by two N atoms from two bpp molecules in an approximately linear geometry. The Ag(Ⅰ) ions are linked by the bpp molecules to form one-dimensional zigzag chains propagating along the c axis. The Hphth-and nitrate counter-ions are bridged by solvent water molecules through hydrogen bonds to generate a one-dimensional chain extending along the b axis. Electrostatic interactions between cations and anions, extensive hydrogen bonds and π-π interactions are responsible for the three-dimensional supramolecular structure. In the solid state, the compound exhibits blue photoluminescence with the maximum at 436 nm upon excitation at 344 nm.  相似文献   

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