Search results for "Isostructural"
showing 10 items of 158 documents
Synthesis, crystal structure and magnetic properties of the dinuclear manganese(II) complexes [Mn2(bpym)3(NCX)4] (bpym = 2,2′-bipyrimidine; X = S, Se)
1997
Abstract The dinuclear manganese(II) compounds of formula [Mn2(bpym)3(NCX)4], where bpym = 2,2′-bipyrimidine and X = S(1) and Se(2), have been prepared and their crystal structures determined by X-ray diffraction methods. 1 and 2 are isostructural. They crystallize in the triclinic P 1 space group with Z = 1, γ ( Mo K α ) = 0.71073 A , T = 295 K and a = 9.141(2), b = 9.248(2), c = 11.733(2) A , α = 74.88(2), β = 80.29(2), γ = 61.03(2)°, V = 836.7(3) A 3 , D c = 1.621 g cm −3 , M r = 316.7, F(000) = 412, and μ( Mo K α) = 10.54 cm −1 for 1 and a = 9.244(2), b = 9.278(2) A , c = 11.887(2) A , α = 75.19(2), β = 80.83(2), γ = 61.54(2)°, V = 865.7(3) A 3 , D c = 1.926 g cm −3 , M r = 1004.3, F(00…
New coordination polymers based on a novel polynitrile ligand: Synthesis, structure and magnetic properties of the series [M(tcnoetOH)2(4,4′-bpy)(H2O…
2008
International audience; A novel polynitrile anionic ligand, tcnoetOH−(=[(NC)2CC(OCH2CH2OH)C(CN)2]−), has been synthesized by a one-pot reaction from a cyclic acetal and malononitrile. This ligand has been successfully used to prepare, with 4,4′-bpy as co-ligand, a novel series of coordination polymers formulated as [M(tcnoetOH)2(4,4′-bpy)(H2O)2] with M(II) = Fe (1), Co (2) and Ni (3). These isostructural compounds present a linear chain structure consisting of octahedrally coordinated metal ions bridged by trans 4,4′-bpy ligands. The coordination sphere of the metal ions is completed with two terminal tcnoetOH− ligand and two water molecules. The magnetic properties indicate that the three …
Syntheses, structures and physical characterization of two new three-dimensional mixed-valence hexadecavanadate derivatives
2007
Abstract Two new hexadecavanadate derivatives, (bpy)[Zn(4,4′-bpy)2]2[H4ClV16O38]·6H2O 1 and (bpy)[Co(4,4′-bpy)2]2[H4ClV16O38]·6H2O 2 (bpy = 4,4′-bipyridine), were synthesized under the hydrothermal conditions and structurally characterized by IR, XPS and EPR spectroscopy, redox titration and single-crystal X-ray diffraction. The two compounds are isostructural and crystallize in the tetragonal non-centrosymmetric space group P-4n2 (No. 118) with a = 17.124(2), b = 17.124(2), c = 14.724(3) A, V = 4317.5(12) A3 and Z = 1 for the compound 1, and a = 17.038(2), b = 17.038(2), c = 14.754(3) A, V = 4282.9(12) A3 and Z = 1 for the compound 2. Compounds 1 and 2 were constructed from 4-connected {H4…
Pressure-Driven Isostructural Phase Transition in InNbO4: In Situ Experimental and Theoretical Investigations
2017
[EN] The high-pressure behavior of technologically important visible-light photocatalytic semiconductor In.NbO4, adopting a monoclinic wolframite-type structure at ambient conditions, was investigated using synchrotron-based X-ray diffraction, Raman spectroscopic measurements, and first-principles calculations. The experimental results indicate the occurrence of a pressure-induced isostructural phase transition in the studied compound beyond 10.8 GPa. The large volume collapse associated with the phase transition and the coexistence of two phases observed over a wide range of pressure shows the nature of transition to be first-order. There is an increase in the oxygen anion coordination num…
Formation and Transformations of Organic Salt Hydrates: Four Encenicline Hydrochloride Monohydrates and Respective Isostructural Desolvates
2018
Encenicline hydrochloride (Enc-HCl) crystallizes in four different monohydrate phases, but at the same time crystallization in a nonsolvated phase is not observed, indicating that water plays a crucial role in guiding the crystallization process and ensuring structure stability. All monohydrate phases show exceptionally high stability, and the main structural motif stays intact even after dehydration, leading to isostructural (for I and II) or isomorphic (for III) desolvates. Three monohydrate phases with determined crystal structure information consists of Enc-HCl-water hexamers that are stacked into similar slabs, that are further packed identically in monohydrates I, II, and III. The fea…
Two Polymorphic Forms of a Six-Coordinate Mononuclear Cobalt(II) Complex with Easy-Plane Anisotropy: Structural Features, Theoretical Calculations, a…
2016
A mononuclear cobalt(II) complex [Co(3,5-dnb)2(py)2(H2O)2] {3,5-Hdnb = 3,5-dinitrobenzoic acid; py = pyridine} was isolated in two polymorphs, in space groups C2/c (1) and P21/c (2). Single-crystal X-ray diffraction analyses reveal that 1 and 2 are not isostructural in spite of having equal formulas and ligand connectivity. In both structures, the Co(II) centers adopt octahedral {CoN2O4} geometries filled by pairs of mutually trans terminal 3,5-dnb, py, and water ligands. However, the structures of 1 and 2 disclose distinct packing patterns driven by strong intermolecular O-H···O hydrogen bonds, leading to their 0D→2D (1) or 0D→1D (2) extension. The resulting two-dimensional layers and one-…
Spin-crossover compounds based on iron(II) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic …
2018
International audience; Four new salts of the iron(II) complex of the 2,6-bis(pyrazol-1-yl)pyridine ligand functionalized with a carboxylic acid group (bppCOOH) of formulas [Fe(bppCOOH)2](BF4)2 (1(BF4)2), [Fe(bppCOOH)2](CF3SO3)2·yMe2CO (1(CF3SO3)2·yMe2CO), [Fe(bppCOOH)2](AsF6)2·yMe2CO (1(AsF6)2·yMe2CO) and [Fe(bppCOOH)2](SbF6)2·yMe2CO (1(SbF6)2·yMe2CO) have been prepared and characterized together with a more complete structural and photomagnetic characterization of the previously reported [Fe(bppCOOH)2](ClO4)2 (1(ClO4)2). Furthermore, the iron(II) complex of the ethyl ester derivative of bppCOOH (bppCOOEt) has been prepared and characterized (compound [Fe(bppCOOEt)2](ClO4)2·yMe2CO, 2(ClO4)…
Hybrid Organic/Inorganic Molecular Materials Formed by Tetrathiafulvalene Radicals and Magnetic Trimeric Clusters of Dimetallic Oxalate‐Bridged Compl…
2003
The first examples of trimeric, dimetallic, pure oxalate-bridged complexes [ox = (C2O4)2−] have been synthesized and characterized structurally and magnetically for the two new series of crystalline molecular assemblies formulated as (TTF)4{MII(H2O)2[MIII(ox)3]2}·nH2O [for MIII = Cr; MII = Mn (1), Fe (2), Co (3), Ni (4), Cu (5) and Zn (6); for MIII = Fe; MII = Mn (7), Fe (8), Co (9), Ni (10) and Zn (11)]. Both series (Cr2M and Fe2M) are isostructural. The crystal structure of (TTF)4{Mn(H2O)2[Cr(ox)3]2}⋅14H2O (1) [monoclinic, space group C2/c (no. 15), a = 13.240(5) A, b = 19.450(5) A, c = 27.690(5) A, β = 97.63(5)°, V = 7068(3) A3 and Z = 4] shows alternating layers of the organic radical T…
Pressure Effect Studies on the 3D Spin Crossover System: {Fe(3CN-py)2[M(CN)2]2}·nH2O (n < 2/3, M = Ag(I), Au(I))
2007
[EN] Pressure effect investigations on the magnetic behaviour of the 3D SCO polymers {Fe(3CN-py)2[Ag(CN)2]2} · 2/3H2O (1) and {Fe(3CN-py)2[Au(CN)2]2} · 2/3H2O (2) have been carried out in the range of 105 Pa to 0.7 GPa. Despite both compounds are isostructural their magnetic behaviour under applied hydrostatic pressures is very different. Strong nonlinearity in the Tc(P) vs. P plot has been observed for compound 1 a fact which contrasts with the almost linear dependence observed for each spin transition in 2. However, both compounds are extremely sensitive to the application of pressure as well as the Tc(P) vs. P plots denote.
In vitro evaluation of leishmanicidal properties of a new family of monodimensional coordination polymers based on diclofenac ligand
2020
Some series of isostructural chains with general formula [M(diclof)(HO)]·(EtOH) have been obtained from reaction between diclofenac ligand (diclof) and first row transition salts (M = Mn (1),Ni (2) and Co (3)). These monodimensional coordination polymers have been characterized and their crystal structures have been solved by X-ray diffraction methods, elucidating isostructural compounds that are chains with water molecules acting as bridge between different metallic centers, while diclofenac ligands are coordinated to the octahedral coordination environment of the same. Magnetic studies of these complexes have revealed the existence of moderate ferromagnetic interactions among manganese, n…