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1.
Two new iron–oxo clusters, viz. di‐μ‐tri­fluoro­acetato‐μ‐oxo‐bis­[(2,2′‐bi­pyridine‐κ2N,N′)(tri­fluoro­acetato‐κO)­iron(III)], [Fe2O(CF3CO2)4(C10H8N2)2], and bis(2,2′‐bi­pyridine)­di‐μ3‐oxo‐hexa‐μ‐tri­fluoro­acetato‐bis­(tri­fluoro­acetato)­tetrairon(III) tri­fluoro­acetic acid solvate, [Fe4O2(CF3CO2)8(C10H8N2)2]·CF3CO2H, contain dinuclear and tetranuclear FeIII cores, respectively. The FeIII atoms are in distorted octahedral environments in both compounds and are linked by oxide and tri­fluoro­acetate ions. The tri­fluoro­acetate ions are either bridging (bidentate) or coordinated to the FeIII atoms via one O atom only. The fluorinated peripheries enhance the solubility of these compounds. Formal charges for all the Fe centers were assigned by summing valences of the chemical bonds to the FeIII atom.  相似文献   

2.
A novel complex [Cu(NnpPy)2(HlTCB)(H1O)]·2H2O (NITpPy = 2‐(pyrid‐4′‐yl)‐4,4,5,5‐tetramethyl‐1, 3‐dioxoimidazoline; H2TCB = 1, 5‐dicarboxybenzene carboxylic‐2, 4‐diacid) has been synthesized and characterized by X‐ray crystallography analysis. The crystal structure consists of infinite chains of Cu‐(NITpPy)2(H2O) units linked by H2TCB ligands. The complex crystallizes in triclinic system with space group PI. Crystal data: a = 1.0594(2) nm, b = 1.3830(3) nm, c = 1.5551(3) nm, a = 67.75(3)°, β = 89.83(3)°, γ = 70.54(3)°. The variable magnetic susceptibility studies lead to magnetic coupling constant values of J1= ?11.18 cm‐1 (Cu—Rad) and J2 = ?4.06 cm?1 (Cu—Cu).  相似文献   

3.
Crystals of Ba Na ethylenediaminetetraacetatocobaltate(III) perchlorate, NaBa2[Co(Edta)]2(ClO4)3 · 9H2O, contain two crystallographically nonequivalent Ba2+ cations and two complex cations [Co(Edta)]? (Edta4? is ethylenediaminetetraacetic acid anion), the latter anions showing opposite chirality. The nearest surrounding of the Ba2+ ions involves three water molecules (including two bridging water molecules), six O atoms of four complexes [Co(Edta)]? and the perchlorate O atom. Tetrameric fragments Ba2(H2O)4[Co(Edta)]2(ClO4)2 are united through the Ba-O bonds into layers with the Ba atoms in the middle of the layers and the perchlorate ions and complex anions at the periphery; in the latter anions, noncoordinated O atom of one of the R-metallocycles is directed outside. The Na atom of the Na(H2O)(ClO4) group located between the layers is bonded to these O atoms of the neighboring layers.  相似文献   

4.
Two CoII complexes, Co(phen)(HL)2 ( 1 ) and [Co2(phen)2(H2O)4L2]·H2O ( 2 ) (H2L = HOOC‐(CH2)5‐COOH), were synthesized and structurally characterized on the basis of single crystal X‐ray diffraction data. In complex 1 the Co atoms are tetrahedrally coordinated by two N atoms of one phen ligand and two O atoms of different hydrogenpimelato ligands. Through π—π stacking interactions between carboxyl group and phen ligand, the complex molecules are assembled into 1D columnar chains, which are connected by intermolecular hydrogen bonds. Complex 2 consists of the centrosymmetric dinuclear [Co2(phen)2(H2O)4L2] molecules and hydrogen bonded H2O molecules. The Co atoms are each octahedrally surrounded by two N atoms of one phen ligand and four O atoms from two bis‐monodentate pimelato ligands and two H2O molecules at the trans positions. The results about thermal analyses, which were performed in flowing N2 atmosphere, on both complexes were discussed. Crystal data: ( 1 ) C2/c (no. 15), a = 13.491(1)Å, b = 9.828(1)Å, c = 19.392(2)Å, β = 100.648(1)°, U = 2526.9(4)Å3, Z = 4; ( 2 ) P1 (no. 2), a = 11.558(1)Å, b = 11.947(3)Å, c = 15.211(1)Å, α = 86.17(1)°, β = 75.55(1)°, γ = 69.95(1)°, U = 1910.3(3)Å3, Z = 2.  相似文献   

5.
The pale‐rose compound [(μ‐C6H8O4)4/2Co(μ‐H2O)2Co(H2O)4] · 4 H2O was prepared from adipic acid and CoCO3 in aqueous solution. The crystal structure (monoclinic, P21/n (no. 14), a = 8.061(1), b = 15.160(2), c = 9.708(2) Å, β = 90.939(7)°, Z = 2, R = 0.0405, wR2 = 0.0971) consists of adipate bridged supramolecular [(μ‐C6H8O4)4/2Co(μ‐H2O)2Co(H2O)4] layers and hydrogen bonded H2O molecules. The cobalt atoms Co1 and Co2 are distorted octahedrally coordinated by the O atoms of two bridging trans‐H2O molecules and four bidentate adipate anions (Co1) and by the O atoms of two bridging trans‐H2O molecules and four monodentate H2O molecules (Co2), respectively. Equatorial bonds: d(Co1–O) = 2.048 Å (2 × ), 2.060 Å (2 × ); d(Co2–O) = 2.057 Å (2 × ), 2.072 Å (2 × ). Axial bonds: d(Co1–O) = 2.235 Å (2 × ); d(Co2–O) = 2.156 Å (2 × ).  相似文献   

6.
The first structurally characterized alkali metal phospho­nate, the title compound, [K2(C6H6O3P)2(C3H7NO)(H2O)]n, has a complex structure, with layers parallel to the crystallographic bc plane consisting of two crystallographically independent K atoms sandwiched between the three types of ligands present in the structure, viz. water molecules, dimethyl­formamide molecules and two crystallographically independent phenyl­phospho­nate ligands. Six O atoms coordinate to one K atom and seven to the other. The interlayer distance is 15.327 (4) Å. The K—O distances are in the range 2.739 (2)–2.932 (2) Å for the seven‐coordinate K atom and 2.650 (2)–2.821 (2) Å for the six‐coordinate K atom.  相似文献   

7.
The blue copper complex compounds [Cu(phen)2(C6H8O4)] · 4.5 H2O ( 1 ) and [(Cu2(phen)2Cl2)(C6H8O4)] · 4 H2O ( 2 ) were synthesized from CuCl2, 1,10‐phenanthroline (phen) and adipic acid in CH3OH/H2O solutions. [Cu(phen)2‐ (C6H8O4)] complexes and hydrogen bonded H2O molecules form the crystal structure of ( 1 ) (P1 (no. 2), a = 10.086(2) Å, b = 11.470(2) Å, c = 16.523(3) Å, α = 99.80(1)°, β = 115.13(1)°, γ = 115.13(1)°, V = 1617.5(5) Å3, Z = 2). The Cu atoms are square‐pyramidally coordinated by four N atoms of the phen ligands and one O atom of the adipate anion (d(Cu–O) = 1.989 Å, d(Cu–N) = 2.032–2.040 Å, axial d(Cu–N) = 2.235 Å). π‐π stacking interactions between phen ligands are responsible for the formation of supramolecular assemblies of [Cu(phen)2(C6H8O4)] complex molecules into 1 D chains along [111]. The crystal structure of ( 2 ) shows polymeric [(Cu2(phen)2Cl2)(C6H8O4)2/2] chains (P1 (no. 2), a = 7.013(1) Å, b = 10.376(1) Å, c = 11.372(3) Å, α = 73.64(1)°, β = 78.15(2)°, γ = 81.44(1)°, V = 773.5(2) Å3, Z = 1). The Cu atoms are fivefold coordinated by two Cl atoms, two N atoms of phen ligands and one O atom of the adipate anion, forming [CuCl2N2O] square pyramids with an axial Cl atom (d(Cu–O) = 1.958 Å, d(Cu–N) = 2.017–2.033 Å, d(Cu–Cl) = 2.281 Å; axial d(Cu–Cl) = 2.724 Å). Two square pyramids are condensed via the common Cl–Cl edge to centrosymmetric [Cu2Cl2N4O2] dimers, which are connected via the adipate anions to form the [(Cu2(phen)2Cl2)(C6H8O4)2/2] chains. The supramolecular 3 D network results from π‐π stacking interactions between the chains. H2O molecules are located in tunnels.  相似文献   

8.
The crystal structures of tris(2‐methyl­quinolin‐8‐olato‐N,O)­iron(III), [Fe­(C10­H8­NO)3], (I), and aqua­bis(2‐methyl­quinolin‐8‐olato‐N,O)­copper(II), [Cu­(C10­H8NO)2­(H2O)], (II), have been determined. Compound (I) has a distorted octahedral configuration, in which the central Fe atom is coordinated by three N atoms and three O atoms from three 2‐methylquinolin‐8‐olate ligands. The three Fe—O bond distances are in the range 1.934 (2)–1.947 (2) Å, while the three Fe—N bond distances range from 2.204 (2) to 2.405 (2) Å. In compound (II), the central CuII atom and H2O group lie on the crystallographic twofold axis and the coordination geometry of the CuII atom is close to trigonal bipyramidal, with the three O atoms in the basal plane and the two N atoms in apical positions. The Cu—N bond length is 2.018 (5) Å. The Cu—O bond length in the basal positions is 1.991 (4) Å, while the Cu—O bond length in the apical position is 2.273 (6) Å. There is an intermolecular OW—H?O hydrogen bond which links the mol­ecules into a linear chain along the b axis.  相似文献   

9.
In the title coordination polymer, [Cd2(SO4)2(C13H8N4)(H2O)2]n, there are two crystallographically independent CdII centres with different coordination geometries. The first CdII centre is hexacoordinated by four O atoms of four sulfate ligands, one water O atom and one N atom of a 1H‐imidazo[4,5‐f][1,10]phenanthroline (IP) ligand, giving a distorted octahedral coordination environment. The second CdII centre is heptacoordinated by four O atoms of three sulfate ligands, one water O atom and two N atoms of one chelating IP ligand, resulting in a distorted monocapped anti‐trigonal prismatic geometry. The symmetry‐independent CdII ions are bridged in an alternating fashion by sulfate ligands, forming one‐dimensional ladder‐like chains which are connected through the IP ligands to form two‐dimensional layers. These two‐dimensional layers are linked by interlayer hydrogen bonds, leading to the formation of a three‐dimensional supramolecular network.  相似文献   

10.
The asymmetric unit of the title compound, [Zn(C10H6NO2)2(C12H8N2)]·1.5C3H7NO, contains one monomeric zinc com­plex and 1.5 disordered di­methyl­form­amide solvate mol­ecules. The Zn atom is coordinated to one 1,10‐phenanthroline ligand and to two iso­quinoline­carboxyl­ate anions (IQC?) via their N and O atoms. The complex exhibits a distorted octahedral geometry around the ZnII atom, with the apical positions occupied by the O atoms of the IQC? ligands. The Zn atom lies 0.049 (1) Å out of the basal plane. The crystal packing is characterized by several hydrogen bonds.  相似文献   

11.
The title complex, [Ag4(C7H5O3)2(C8H6N2)4(C7H6O3)4], lies about an inversion centre and has a unique tetra­nuclear structure consisting of four AgI atoms bridged by four N atoms from two 1,8‐naphthyridine (napy) ligands to form an N:N′‐bridge and four O atoms from two salicylate (SA) ligands to form an O:O′‐bridge. The Ag atoms have distorted octa­hedral coordination geometry. The centrosymmetric Ag4 ring has Ag—Ag separations of 2.772 (2) and 3.127 (2) Å, and Ag—Ag—Ag angles of 107.70 (4) and 72.30 (4)°. All SA hydroxy groups take part in intra­molecular O—H⋯O hydrogen bonding. In the crystal packing, the napy rings are oriented parallel and overlap one another. These π–π inter­actions, together with weak inter­molecular C—H⋯O contacts, stabilize the crystal structure.  相似文献   

12.
Reactions of 1,10‐phenanthroline monohydrate, Na2C4H4O4 · 6 H2O and MnSO4 · H2O in CH3OH/H2O yielded a mixture of [Mn2(H2O)4(phen)2(C4H4O4)2] · 2 H2O ( 1 ) and [Mn(phen)2(H2O)2][Mn(phen)2(C4H4O4)](C4H4O4) · 7 H2O ( 2 ). The crystal structure of 1 (P1 (no. 2), a = 8.257(1) Å, b = 8.395(1) Å, c = 12.879(2) Å, α = 95.33(1)°, β = 104.56(1)°, γ = 106.76(1)°, V = 814.1(2) Å3, Z = 1) consists of the dinuclear [Mn2(H2O)4(phen)2(C4H4O4)2] molecules and hydrogen bonded H2O molecules. The centrosymmetric dinuclear molecules, in which the Mn atoms are octahedrally coordinated by two N atoms of one phen ligand and four O atoms from two H2O molecules and two bis‐monodentate succinato ligands, are assembled via π‐π stacking interactions into 2 D supramolecular layers parallel to (101) (d(Mn–O) = 2.123–2.265 Å, d(Mn–N) = 2.307 Å). The crystal structure of 2 (P1 (no. 2), a = 14.289(2) Å, b = 15.182(2) Å, c = 15.913(2) Å, α = 67.108(7)°, β = 87.27(1)°, γ = 68.216(8)°, V = 2934.2(7) Å3, Z = 2) is composed of the [Mn(phen)2(H2O)2]2+ cations, [Mn(phen)2(C4H4O4)] complex molecules, (C4H4O4)2– anions, and H2O molecules. The (C4H4O4)2– anions and H2O molecules form 3 D hydrogen bonded network and the cations and complex molecules in the tunnels along [001] and [011], respectively, are assembled via the π‐π stacking interactions into 1 D supramolecular chains. The Mn atoms are octahedrally coordinated by four N atoms of two bidentate chelating phen ligands and two water O atoms or two carboxyl O atoms (d(Mn–O) = 2.088–2.129 Å, d(Mn–N) = 2.277–2.355 Å). Interestingly, the succinato ligands in the complex molecules assume gauche conformation bidentately to chelate the Mn atoms into seven‐membered rings.  相似文献   

13.
The title compound [La(phen)2(H2O)2(NO3)2](NO3) · 2(phen)(H2O) with phen = 1,10‐phenanthroline was prepared by the stoichiometric reaction of La(NO3)3 · 6 H2O and 1,10‐phenanthroline monohydrate in a CH3OH–H2O solution. The crystal structure (triclinic, P 1 (no. 2), a = 11.052(2), b = 13.420(2), c = 16.300(2) Å, α = 78.12(1)°, β = 88.77(1)°, γ = 83.03(1)°, Z = 2, R = 0.0488, wR2 = 0.1028) consists of [La(phen)2(H2O)2(NO3)2]2+ complex cations, NO3 anions, phen and H2O molecules. The La atom is 10‐fold coordinated by four N atoms of two bidentate chelating phen ligands and six O atoms of two H2O molecules and two bidentate chelating NO32– ligands with d(La–O) = 2.522–2.640 Å and d(La–N) = 2.689–2.738 Å. The intermolecular π‐π stacking interactions play an essential role in the formation of two different 2 D layers parallel to (001), which are formed by complex cations and uncoordinating phen molecules, respectively. The uncoordinated NO3 anions and H2O molecules are sandwiched between the cationic and phen layers.  相似文献   

14.
In the title coordination polymer, {[Ba(C8H5Cl2O3)2(H2O)]·H2O}n, each BaII atom is nine‐coordinated by six carboxyl­ate O atoms and one ether O atom from five symmetry‐related 2,4‐dichloro­phenoxy­acetate ligands, and by two O atoms from water mol­ecules, thus defining a distorted tricapped trigonal prism. The BaII ions are bridged by bidentate water mol­ecules and by tridentate and tetra­dentate 2,4‐dichloro­phenoxy­acetate groups, leading to a two‐dimensional layer structure. The crystal structure is further stabilized by hydrogen‐bonding inter­actions within each layer.  相似文献   

15.
In the title mixed‐ligand metal–organic polymeric complex, {[Co(NCS)2(C8H12N6)2]·2H2O}n, the asymmetric unit contains a divalent CoII cation, which sits on an inversion centre, two halves of two crystallographically distinct and centrosymmetric 1,4‐bis(1,2,4‐triazol‐1‐yl)butane (BTB) ligands, one N‐bound thiocyanate ligand and one solvent water molecule. The CoII atom possesses a distorted {CoN6} octahedral geometry, with the equatorial positions taken up by triazole N atoms from four different BTB ligands. The axial positions are filled by thiocyanate N atoms. In the crystal, each CoII atom is linked covalently to four others through the distal donors of the tethering BTB ligands, forming a neutral (4,4)‐topology two‐dimensional rhomboid grid layer motif, which is coincident with the (11) crystal planes. Magnetic investigations show that weak antiferromagnetic coupling exists between CoII atoms in the complex.  相似文献   

16.
The preparation and physical properties of the new heterotrinuclear acetates, [Ru2CO(μ3-O)(μ-CH3CO2)6(Py)3] (Ru2Co(II)) and [Ru2Co(μ3-O)(μ-CH3CO2)6(Py)3)l3 (Ru2Co(III), Py = pyridine), are reported. Three reversible one-electron-redox waves are observed at 1.19, 0.40, and ?1.24 V vs Ag/Ag+ electrode for Ru2Co(lI) in CH2Cl2. The complexes of Ru2Co(II) and Ru2Co(III) show an intense visible absorption at 570 (? 5950 M?1 cm?1) and 551 nm (? 7240 M?1 cm?1), respectively. The magnetic susceptibilities of both complexes were also measured from 4.2 to 300 K. The resulting least-squares fit parameters for Ru2Co(II) areJRuCo = ?9 cm?1, JRuRu = ?22 cm?1, gCo, = gRu= 2.19.  相似文献   

17.
The single crystal X‐ray analysis of a novel thiophene‐2,5‐dicarboxylic acid (H2Tda) Manganese(II) coordination polymer, {Mn23‐Tda)2(μ‐H2O)(H2O)2(bipy)]·DMF}n, shows two different types of Mn2+‐ions with environment of Mn1O6 and Mn2O4N2, and the complex is a two‐dimensional polymer as a result of bridging (Tda)2? ligands and by connecting the carboxylate‐ and water‐bridged {Mn2(μ‐Tda)2(μ‐H2O)} nodes.  相似文献   

18.
A novel La( III )‐Cu( II ) heterometallic coordination polymer {[LaCu2(NTA)2(4,4′‐bpy)(H2O)3]NO3·5H2O]n, where H3NTA denotes nitrilotriacetic acid and 4,4′‐bpy denotes 4, 4‐bipyridine, was synthesized and characterized by IR spectrum, elemental analysis and X‐ray diffraction. The complex crystallizes in the triclinic space group Pi with cell parameters a = 1.33710(10) nm, b = 1,44530(10) nm, c =1.0949(2) nm, α = 71.905(7)°, β = 74.327(7)°, γ = 64.427(9)°, V = 1.7912(4) nm3and Z = 2. It consists of heterometallic units, in which each La( II ) ion is coordinated in a distorted monocapped square antiprism by three oxygen atoms from water molecules and six carboxyl oxygen atoms from five NTA3? ions, and each Cu( I ) ion is coordinated by one nitrogen atom from 4,4′‐bpy and one nitrogen atom, three oxygen atoms from NTA3?. In the title complex, La( I ) ions and Cu( II ) ions are connected by the heterometallic bridging of NTA3?, constructing a two‐dimensional network structure along the [110]. And it is extended into an infinite three‐dimensional network structure by the formation of homometallic bridging of Cu‐4, 4′‐bpy‐Cu, exhibiting a certain inclusion ability.  相似文献   

19.
The binuclear praseodymium(III) complex with N‐(1‐carboxyethylidene)‐salicylhydrazide (C10H10N2O4, H2L) was prepared in H2O‐C2H5OH mixed solution, and the crystal structure of [Pr2L2(HL)2(H2O)4]·3H2O·C6H6 was determined by X‐ray single crystal diffraction. The crystal complex crystallizes in the triclinic system with space group P‐1, and in the structure each Pr atom is 9‐coordinated by carboxyl O and acyl O and azomethine N atoms of two tridentate ligands to form two stable five‐membered rings sharing one side in keto‐mode and two water molecules. The coordination polyhedron around Pr3+ was described as a monocapped square antiprism geometry. In an individual molecule, four tridentate ligands were coordinated by two negative univalent (HL) and two bivalent forms (L) respectively. Two negative univalent ligands were coordinated via μ2‐bridging mode.  相似文献   

20.
A noval cobalt(II) coordination polymer, {[Co(bpmb)(H2O)2(C2H5OH)2]·(NO3)2}‐ (1). where bpmb=N,N′‐bis(3‐pyridylmethyl)‐1,4‐benzenedicarboxamide, was synthesized by self‐assembly of the two topic ligands with cobalt nitrate in ethanol solution, and characterized structurally by X‐ray crystallography analysis. The crystal data belong to triclinic, space group P1 with cell parameters a=0.8911(3) nm, b=0.9042(3) nm, c= 1.0068(3) nm, α= 73.083(5)°, β=81.069(5)°, γ=76.210(5)°, R1=0.0518, wR2=0.0947. The results of structure analysis indicate that each bpmb ligand coordinates two Co(II) atoms and each metal atom is in octahedral coordination geometry with four oxygen atoms of two ethanol and two water molecules, two nitrogen atoms from two different bpmb ligands in trans position forming an infinite 1D chain‐like structure. There BTC hydrogen bonding and π‐π stacking interaction among these chains, leading to supramolecular formation with 3D net structure.  相似文献   

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