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1.
以4-(1H-1,2,4-三氮唑)苯甲酸为配体,采用水热法合成了2种稀土配位聚合物[Tb(tbc3)(H2O)3]n(1)和{[Nd(tbc3)(H2O)3]·H2O}n(2)(Htbc=4-(1H-1,2,4-三氮唑)苯甲酸)。运用X-射线单晶衍射法对该配位聚合物进行了结构测定,并对其进行了元素分析、红外光谱、TG及荧光光谱表征。单晶结构表明,配位聚合物1为三斜晶系,空间群P1,配位聚合物2属于单斜晶系,空间群为P21/c。配位聚合物1和2均为一维链结构,均通过非共价键作用形成三维超分子构造。 相似文献
2.
水热条件下,合成了2个结构新颖的金属配位聚合物:[Co1.5(btb)2(nbta)(H2O)2]n(1),[Cd(btb)0.5(nph)(H2O)]n(2)(btb=4,4'-二(1,2,4-三氮唑-1-基)联苯,H3nbta=5-硝基-1,2,3-苯三甲酸,H2nph=3-硝基邻苯二甲酸)并对它们进行了元素分析,红外光谱及X-射线单晶衍射等表征。结构分析表明,化合物1是一个二维(3,4)-连接3,4L90拓扑结构,并进一步通过O-H…O氢键作用构筑成三维超分子结构。而配合物2是一个三维(3,4,4)-连接的sqc69网络,它的拓扑符号为(4.82)2(42.82.102)(8.104.12)。此外,还研究了这两个配合物的热重和荧光性质。 相似文献
3.
水热条件下,合成了2个结构新颖的金属配位聚合物:[Co1.5(btb)2(nbta)(H2O)2]n(1),[Cd(btb)0.5(nph)(H2O)]n(2)(btb=4,4'-二(1,2,4-三氮唑-1-基)联苯,H3nbta=5-硝基-1,2,3-苯三甲酸,H2nph=3-硝基邻苯二甲酸)并对它们进行了元素分析,红外光谱及X-射线单晶衍射等表征。结构分析表明,化合物1是一个二维(3,4)-连接3,4L90拓扑结构,并进一步通过O-H…O氢键作用构筑成三维超分子结构。而配合物2是一个三维(3,4,4)-连接的sqc69网络,它的拓扑符号为(4.82)2(42.82.102)(8.104.12)。此外,还研究了这两个配合物的热重和荧光性质。 相似文献
4.
以4-(1H-1,2,4-三氮唑)苯甲酸为配体,采用水热法合成了2种稀土配位聚合物[Tb(tbc3)(H2O)3]n(1)和{[Nd(tbc3)(H2O)3]·H2O}n(2)(Htbc=4-(1H-1,2,4-三氮唑)苯甲酸)。运用X-射线单晶衍射法对该配位聚合物进行了结构测定,并对其进行了元素分析、红外光谱、TG及荧光光谱表征。单晶结构表明,配位聚合物1为三斜晶系,空间群P1,配位聚合物2属于单斜晶系,空间群为P21/c。配位聚合物1和2均为一维链结构,均通过非共价键作用形成三维超分子构造。 相似文献
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7.
以1,3-二氟苯为起始原料,依次经傅-克酰基化,1H-三氮唑取代,环氧化,胺解,4H-三氮唑环化,磷酸酯化和钯碳加氢反应等7步反应合成了福司氟康唑的主要杂质--2-(2,4-二氟苯基-1-(1H-1,2,4-三氮唑-1-基)-3-(4H-1,2,4-三氮唑-4-基)-2-丙基磷酸二氢酯,纯度98%,总收率7.8%,其结构经1H NMR确证。 相似文献
8.
采用水热法合成了4个配位聚合物[Zn(Hcpoia)(2,2’-bpy)·H2O]n(1)和[M(Hcpoia)(phen)]n·nH2O[M=Zn(2),Mn(3),Co(4); H3cpoia=4-(4-羧基苯氧基)间苯二甲酸; 2,2’-bpy=2,2’-联吡啶; phen=1,10-邻菲罗啉],利用X射线单晶衍射分析确定了配合物的晶体结构。配合物1为一维链状结构,中心Zn2+离子的配位环境为[ZnO4N2]扭曲的八面体构型,配体Hcpoia2-以μ1∶η1η0和μ1∶η1η1配位模式桥连相邻的Zn2+离子。配合物2和4的结构与配合物1类似,是由配体Hcpoia2-以μ1∶η1 相似文献
9.
以4-(1-咪唑基)-苯甲酸(HIBA)为配体,与Cu(NO_3)2·6H_2O和Cd(Ac)_2·2H_2O在加入或不加入5-硝基间苯二甲酸(H_2NPA)的情况下,通过水热法得到了3个新的配位聚合物,分别为{[Cu(IBA)_2]·DMF}n(1)、{[Cd(IBA)2(H_2O)]·3H_2O}n(2)和[Cd_3(IBA)_2(NPA)_2]n(3)。配合物1和2分别为4重和3重穿插的具有金刚石拓扑网络的三维框架结构,配合物3是由混合配体形成的基于一维Cd-羧基次级构筑基元的三维框架结构,其一维构筑基元由Cd髤离子通过IBA-和NPA2-配体同时桥联形成的。此外,还表征了这些化合物的晶相纯度以及配合物2和3的荧光性质。 相似文献
10.
以5-甲氧基间苯二甲酸(CH_3O-H_2ip),2,2′-二甲基-4,4′-联吡啶(dmbpy)和四水硝酸镉/六水硝酸钴为原料,在混合溶剂中合成2个一维金属有机配位聚合物,{[Cd_2(CH_3O-ip)_2(ethanol)_2(H_2O)_4]·3H_2O}_n(1)和{[Co_2(CH_3O-ip)_2(dmbpy)(H_2O)_4]·H_2O·C_2H_3N}_n(2)(C_2H_3N=乙腈)。通过元素分析、红外光谱、差热分析、X射线粉末衍射和X射线单晶衍射等手段对配合物进行了结构表征。结果显示,化合物1为一维浪形结构,通过O-H…O分子间氢键作用构筑成二维结构;而2为一维梯形结构,通过O-H…O,O-H…N和C-H…O分子间氢键作用构筑成三维结构。常温固态下,考察了配合物1的荧光性质,并考查了化合物1和2对甲基橙的催化降解活性。 相似文献
11.
《Journal of Coordination Chemistry》2012,65(11):2010-2019
Three new coordination polymers, {[Cu(trza)(2,2′-bipy)(H2O)]?·?(ClO4)} n (1), {[Cu(trza)(2,2′-bipy)(H2O)]?·?(BF4)} n (2), and {[Cu(trza)(4,4′-bipy)]?·?(H2O)?·?(ClO4)} n (3) (Htrza?=?2-(1H-1,2,4-triazole)-1-acetic acid), have been synthesized and characterized by single-crystal X-ray diffraction analysis. Both 1 and 2 exhibit 1-D chain structure while 3 displays 2-D layer structure. The catalytic activities of 1 and 3 in the green oxidative coupling of 2,6-dimethylphenol have been investigated. 相似文献
12.
Yun-Jian Li Wen-Yuan Xu Chang-Bao Han Qing-Yan Liu 《Journal of Coordination Chemistry》2017,70(1):127-134
Reactions of cadmium(II) salts with 3-amino-5-methylthio-1H-1,2,4-triazole (Hamstz) afforded two cadmium(II) coordination polymers, [Cd2(amstz)2Cl2]n (1) and [Cd2(amstz)2(NO3)2]n (2). Compounds 1 and 2 feature 2-D layered structures based on the dinuclear [Cd2(amstz)2] subunits. The cadmium coordination polyhedra are tetrahedral and tetragonal pyramidal in 1 and 2, respectively, due to the presence of different coordinated anions, Cl? and NO3?. Compounds 1 and 2 exhibit photoluminescence emission with maxima at 620 and 621 nm upon excitation at 470 and 472 nm, respectively, which can be attributed to the ligand-to-metal charge transfer emssion. 相似文献
13.
Yan Wei Lei Zhang Meng‐Jie Wang Si‐Chun Chen Zi‐Hao Wang Kou‐Lin Zhang 《Acta Crystallographica. Section C, Structural Chemistry》2015,71(7):570-577
Copper(II) coordination polymers have attracted considerable interest due to their catalytic, adsorption, luminescence and magnetic properties. The reactions of copper(II) with 2‐amino‐4‐sulfobenzoic acid (H2asba) in the presence/absence of the auxiliary chelating ligand 1,10‐phenanthroline (phen) under ambient conditions yielded two supramolecular coordination polymers, namely (3‐amino‐4‐carboxybenzene‐1‐sulfonato‐κO1)bis(1,10‐phenanthroline‐κ2N,N′)copper(II) 3‐amino‐4‐carboxybenzene‐1‐sulfonate monohydrate, [Cu(C7H6N2O5S)(C12H8N2)2](C7H6N2O5S)·H2O, (1), and catena‐poly[[diaquacopper(II)]‐μ‐3‐amino‐4‐carboxylatobenzene‐1‐sulfonato‐κ2O4:O4′], [Cu(C7H6N2O5S)(H2O)2]n, (2). The products were characterized by FT–IR spectroscopy, thermogravimetric analysis (TGA), solid‐state UV–Vis spectroscopy and single‐crystal X‐ray diffraction analysis, as well as by variable‐temperature powder X‐ray diffraction analysis (VT‐PXRD). Intermolecular π–π stacking interactions in (1) link the mononuclear copper(II) cation units into a supramolecular polymeric chain, which is further extended into a supramolecular double chain through interchain hydrogen bonds. Supramolecular double chains are then extended into a two‐dimensional supramolecular double layer through hydrogen bonds between the lattice Hasba− anions, H2O molecules and double chains. Left‐ and right‐handed 21 helices formed by the Hasba− anions are arranged alternately within the two‐dimensional supramolecular double layers. Complex (2) exhibits a polymeric chain which is further extended into a three‐dimensional supramolecular network through interchain hydrogen bonds. Complex (1) shows a reversible dehydration–rehydration behaviour, while complex (2) shows an irreversible dehydration–rehydration behaviour. 相似文献
14.
Bing-Feng Li Xi-Ting Xu Tong-Min Dong Wan-Ying Zhou Yang Gu Lei Gong Kai-Long Zhong 《Acta Crystallographica. Section C, Structural Chemistry》2020,76(4):314-321
The judicious selection of suitable ligands is vitally important in the construction of novel metal–organic frameworks (MOFs) with fascinating structures and interesting properties. Recently, imidazole‐containing multidentate ligands have received much attention. Two new CdII coordination frameworks, namely, poly[tris{μ‐1,4‐bis[(1H‐imidazol‐1‐yl)methyl]benzene‐κ2N3:N3′}tetrakis(nitrato‐κ2O,O′)dicadmium], [Cd2(NO3)4(C14H14N4)3]n, (I), and poly[[bis{μ3‐1,3,5‐tris[(1H‐imidazol‐1‐yl)methyl]benzene‐κ3N3:N3′:N3′′}cadmium] hexafluorosilicate], {[Cd(C18H18N6)2](SiF6)}n, (II), have been synthesized and characterized by elemental analysis, IR spectroscopy and single‐crystal X‐ray diffraction. In polymer (I), the 1,4‐bis[(1H‐imidazol‐1‐yl)methyl]benzene ligand bridges Cd2+ ions with a distorted seven‐coordinated pentagonal bipyramidal geometry, forming a one‐dimensional ladder chain, and the nitrate anions coordinate to the Cd2+ ions in a terminal bidentate fashion. In the crystal, adjacent chains are further connected by C—H…O hydrogen bonds to generate a two‐dimensional (2D) supramolecular structure. Polymer (II) exhibits a 2D layered structure in which 1,3,5‐tris[(1H‐imidazol‐1‐yl)methyl] benzene ligands join Cd2+ centres having a six‐coordinated octahedral structure. The layers are connected by hexafluorosilicate anions via C—H…F hydrogen‐bond interactions, giving rise to a three‐dimensional supramolecular network structure in the solid state. In addition, powder X‐ray diffraction (PXRD) patterns were recorded, thermogravimetric analyses (TGA) carried out and fluorescence properties investigated. 相似文献
15.
Two zinc coordination polymers, {[Zn(HATr)2](NO3)2}n (1) and {[Zn2(HATr)4](ZnCl4)(NO3)2·H2O}n (2), were synthesized from reactions of 3-hydrazino-4-amino-1,2,4-triazole dihydrochloride (HATr·2HCl) with Zn(NO3)2. The polymers were characterized by single-crystal X-ray diffraction, Fourier transform infrared spectroscopy (FTIR), elemental analysis, and differential scanning calorimetry. The crystal structures revealed that 1 and 2 have 1-D-chain structures, which were further assembled to form 3-D-frameworks by hydrogen bonds. Thermal analyses showed that these two compounds have thermal stability up to 280 °C. The energies of combustion, enthalpies of formation, critical temperatures of thermal explosion, entropies of activation (ΔS≠), enthalpies of activation (ΔH≠), and free energies of activation (ΔG≠) were also measured and calculated. Furthermore, the sensitivities of 1 and 2 toward impact, friction, and static were determined, which revealed that 1 and 2 were less sensitive than Ni(N2H4)3(NO3)2. 相似文献
16.
《Journal of Coordination Chemistry》2012,65(7):1113-1124
The syntheses, crystal structures, and thermal properties of the coordination polymers [Ca(H2O)2(L1)2]?·?H2O (1) (L1?=?4-methoxyphenylacetate) and [Ca(H2O)2(L2)2]?·?2H2O (2) (L2?=?2-chlorophenylacetate) are described. 1 and 2 can be dehydrated to the anhydrous [Ca(L1)2] (1a) or [Ca(L2)2] (2a), respectively. Compounds 1 and 2 crystallize in the non-centrosymmetric monoclinic space group P21 and the structures consist of a central Ca(II), two terminal waters, and two crystallographically unique L1 (or L2) anions, one of which functions as a chelating bidentate ligand. The second independent L1 (or L2) is tetradentate, coordinated in a μ3-bridging mode leading to the formation of a 1-D coordination polymer. In the infinite chain extending along the b-axis, each Ca(II) is eight-coordinate and bonded to two terminal waters and six oxygens from four different L1 or L2 ligands. 相似文献
17.
Three new d10 coordination polymers, namely [Cd(taa)Cl]n1, [Hg(taa)Cl]n2, and [Ag1.5(taa)(NO3)0.5]n3 (taa=1H-1,2,4-triazole-1-acatate anion) have been prepared and characterized by elemental analysis, IR, and single crystal X-ray diffraction. Compound 1 consists of two-dimensional layers constructed by carboxyl-linked helical chains, which are further linked through carboxyl group to generate a unique 3D open framework. Topological analysis reveals that the structure of 1 can be classified as an unprecedented (3,8)-connected network with the Schläfli symbol (4.52)2(42.58.614.73.8). Compound 2 manifests a doubly interpenetrated decorated α-polonium cubic network with the Schläfli symbol of (410.62.83). Compound 3 consists of 2D puckered layers made up of Ag centers and taa− bridges. In addition, all of these compounds are photoluminescent in the solid state with spectra that closely resemble those of the ligand precursor. 相似文献
18.
Crystal,molecular structure and tautomerism of (5-methyl-1H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid
Roman I. Zubatyuk Svetlana V. Shishkina Lyudmila I. Kucherenko Ivan A. Mazur Oleg V. Shishkin 《Structural chemistry》2008,19(3):407-412
Molecular structure, relative stability of conformers, and tautomers of (5-methyl-1H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid
(MTSA) have been investigated by experimental (X-ray diffraction) and theoretical (B3LYP/aug-cc-pVDZ) methods. It was demonstrated
that in the solid state MTSA exists in N1H tautomeric form. This tautomer is not the most stable in gas phase and its stabilization
is provided by environment effects. 相似文献
19.
O. G. Shakirova D. Yu. Naumov Yu. G. Shvedenkov N. I. Alferova G. V. Dolgushin L. G. Lavrenova 《Journal of Structural Chemistry》2003,44(4):642-649
A new trinuclear nickel(II) complex with 4-(pyridyl-2)-1,2,4-triazole (pytrz), [Ni3(pytrz)6(H2O)6](NO3)6, has been synthesized, and its crystal structure has been determined. The compound was studied by X-ray phase analysis (XRPA), magnetochemical measurements, and electronic and IR spectroscopy. 相似文献
20.
《Journal of Coordination Chemistry》2012,65(20):3531-3540
The coordination ability of 4-amino-4H-1,2,4-triazole with Pt(II), both in solution and solid states, is elucidated by conventional and linear-polarized IR spectroscopy of oriented colloid suspensions in nematic host, 1H- and 13C-NMR, UV-Vis spectroscopy, mass spectrometry (ESI and FAB), TGV, and DSC methods. The interpretation of the spectroscopic characteristics of corresponding metal complexes is obtained by comparison with free 4-amino-4H-1,2,4-triazole. In addition, quantum chemical calculations of the last compound are performed to obtain data for electronic structures and optical properties of the ligand, thus supporting the experimental elucidation. The evaluation of the cell viability on a panel of human tumor cell lines is made. The new Pt(II) complexes exerted cytotoxic effects in a concentration-dependent manner. 相似文献