Search results for "Crystal system"
showing 10 items of 13557 documents
Synthesis, characterisation, crystal structures, and magnetic properties of one-dimensional oxalato-bridged metal(II) complexes with 3-hydroxypyridin…
2001
One-dimensional oxalato-bridged metal(II) compounds of formula [M(-ox)(L)2]n [L = 3-hydroxypyridine (pyOH) or isoquinoline (isq)] have been synthesised and characterised by FT-IR spectroscopy, TG-DTA techniques, variable-temperature magnetic measurements and X-ray diffraction methods. The complexes [M(-ox)(pyOH)2]n [M= Co (1), Ni (2)] are isomorphous and crystallise in the orthorhombic space group Pnab. The compounds [M(-ox)(isq)2]n [M= Co (3), Ni (4), Cu (5)] are also isomorphous and belong to the monoclinic space group C2/c. Crystal structures consist of zig-zag chains in which cis-[M(L)2] 2 + units are sequentially bridged by bis-bidentate oxalato ligands with intrachain M···M distances …
A triclinic polymorph of (−)-(S)-N-benzyl-2-[(R)-6-fluorochroman-2-yl]-2-hydroxyethanaminium bromide
2013
The title salt, C18H21FNO2+·Br−, determined at 115 K, crystallizes in the triclinic space groupP1. The previously reported polymorph occurs in the monoclinic space groupP21and has two independent molecules in the asymmetric unit [Peeterset al.(1993).Acta Cryst.C49, 2157–2160]. In the title molecule, the pyran rings adopt half-chair conformations. The absolute configuration isSfor the hydroxy-bearing C atom andRfor the asymmetric C atom in the dihydropyran unit. In the crystal, the components are linked by N—H...Br and O—H...Br hydrogen bonds, forming chains along thec-axis direction. The crystal studied was refined as an inversion twin.
Structural Characterization and Magnetic Properties of the First 2,2‘-Bipyrimidine-Containing Iron(III) Complexes
1998
Two new iron(III) complexes of the formulas [Fe(bpm)Cl3(H2O)]·H2O (1) and [Fe2(bpm)Cl6(H2O)2]·2H2O (2) (bpm = 2,2‘-bipyrimidine) have been synthesized and their crystal structures determined by single-crystal X-ray diffraction. 1 and 2 crystallize in the monoclinic system, space group P21/n, with a = 8.593(2) A, b = 17.669(4) A, c = 8.928(2) A, β = 102.36(2)°, and Z = 4 for 1 and a = 6.422(3) A, b = 11.999(4) A, c = 12.297(6) A, β = 93.82(4)°, and Z = 2 for 2. The structure of complex 1 is made up of neutral [Fe(bpm)Cl3(H2O)] mononuclear units and water molecules of crystallization. The monuclear units are linked through hydrogen bonds involving the coordinated water molecule and one of the…
Crystal structure and IR spectrum of 1-O-α-d-glucopyranosyl-d-mannitol–ethanol (2/1)
1999
Abstract 1- O - α - d -Glucopyranosyl- d -mannitol–ethanol (2/1), (C 12 H 24 O 11 ) 2 –C 2 H 5 OH, crystallizes in the monoclinic space group P2 1 with unit cell dimensions a =11.4230(8) A, b =9.525(4) A, c =15.854(2) A, β =102.751(7)° and V =1682.4(7) A 3 , Z =2, D x =1.45 Mg m −3 , λ (Mo-K α )=0.71069 A, μ=0.128 mm −1 , F (000)=788 and T =293(2) K. The structure was solved by direct methods and refined by least-squares calculations on F 2 to R 1 =0.0371[ I >2 σ ( I )], and 0.0930 (all data, 3542 independent reflections, R int =0.021). There are two molecules of glucopyranosylmannitol (GPM) and one ethanol molecule in the asymmetric unit, and the glucopyranosyl ring adopts a chair conforma…
The crystal and molecular structures of hexaquocobalt(II) diisonicotinate N-oxide and its isostructural nickel(II) homologue
1981
Abstract In this experiment the crystal and molecular structures of hexaaquocobalt(II)diisonicotinate N-oxide were determined from three-dimensional X-ray diffraction dat. The crystals belong to the monoclinic space group P2 1 /c. The cell parameters are a = 7.74(2), b = 9.826(2), c = 11.474(2) A , β = 91.08(2)°, V = 873.2(3) A 3 for the Co-complex, and a = 7.765(2), b = 9.725(6), c = 11.363 A , β = 91.20(3)°, V = 857.9(7) A 3 for the Ni-complex. Both structures were refined to a final R-value of 0.045. The X-ray structure analysis showed that there are metal(II)hexaquo cations and isonicotinate N-oxide anions formulated as Co(H 2 O) 6 2+ 2L − and Ni(H 2− O) 6 2+ 2L − in the structures. The…
Coordination behavior of sulfathiazole. Crystal structure of [Cu (sulfathiazole) (py)3Cl] superoxide dismutase activity
1995
Abstract The preparation, spectroscopic, magnetic properties, and crystal structure of [Cu(stzxpy) 3 Cl] (stz − stands for the deprotonated form of sulfathiazole, 4-amino-N-2-thiazolylbencenosulfonamide) are reported. Crystals are orthorhombic, space group Pbca, with cell constants a = 15.834(2), b = 17.512(4), and c = 18.79(2) A, and Z = 8. The structure was solved and refined to R = 0.041 (R W = 0.040). The structure consists of mononuclear units linked via hydrogen bonds to form the tridimensional pyramid. The geometry of CuN3N*NCl chromophore is distorted square-pyramid. The superoxide-dismutase mimetic activity of the compound is measured and compared with those of the SOD enzyme, the …
Electrocatalysis of the oxidation of methylenedioxyamphetamines at electrodes modified with cerium-doped zirconias
2004
The catalytic effect of monoclinic and tetragonal cerium-doped zirconias (m-CexZr1−xO2 and t-CexZr1−xO2, 0<x<0.10, respectively), prepared from gel precursors, on the oxidation of methylenedioxyamphetamine (MDA) and methylenedioxymetamphetamine (MDMA) at pH 7.0 has been studied. Upon attachment of synthetic specimens to polymer film electrodes, an oxidation peak near to +1.05 V vs AgCl/Ag appears that is unaffected by chloride ions and common interfering compounds, namely, dopamine, norepinephrine and ascorbic acid. The catalytic effect appears to be strongly influenced by crystallinity of specimens and coordination of cerium, increasing from the amorphous starting material to t-CexZr1−xO2 …
Selective oxidation of ethane: Developing an orthorhombic phase in Mo–V–X (X=Nb, Sb, Te) mixed oxides
2009
Abstract Mo–V–X (X = Nb, Sb and/or Te) mixed oxides have been prepared by hydrothermal synthesis and heat-treated in N2 at 450 °C or 600 °C for 2 h. The calcination temperature and the presence or absence of Nb determines the nature of crystalline phases in the catalyst. Nb-containing catalysts heat-treated at 450 °C are mostly amorphous solids, while Nb-free catalysts heat-treated at 450 °C and samples treated at 600 °C clearly contain crystalline phases. TPR-H2 experiments show higher H2-consumption on catalysts with amorphous phases. Catalytic results in the oxidative dehydrogenation of ethane indicate that the selective production of the olefin is strongly related to the development of …
Synthesis, structure and conductivity of Ag2ZnSiO4, Ag2ZnGeO4 and Ag2BeSiO4
1995
Abstract The compounds Ag2MM′O4 with MM′ = ZnSi, ZnGe and BeSi have been synthesised by reacting the corresponding Na compounds with molten AgNO3. The crystal structures of Ag2ZnSiO4 and Ag2ZnGeO4 have been refined from Cu K α1 powder diffractometer data by the Rietveld technique to RF = 3.3 and 7.1%, respectively. They are isostructural with monoclinic Na2ZnSiO4. The powder pattern of Ag2BeSiO4 indicates that it is isostructural with orthorhombic Na2BeSiO4. The conductivity of the compounds has been determined using ac impedance measurements. Ag2ZnSiO4 and Ag2BeSiO4 are ionic conductors, with conductivities that are very similar to those of their corresponding isostructural Na compounds. A…
Structural Evolution and Vanadium Distribution in the Preparation of V4+-ZrSiO4 Solid Solutions from Gels
2004
Vanadium-containing ZrSiO4-gel precursors with nominal compositions Vx-ZrSiO4 with x= 0.0, 0.002, 0.004, 0.01, 0.02, 0.03, 0.04, 0.05, 0.06, 0.1, and 0.2 were prepared using a previously reported procedure and thermally treated over a range of temperature up to the formation of the V4+-ZrSiO4 solid solution. The structural evolution and the V4+ location and its homogenous distribution were followed using powder X-ray diffractometry and electron spin resonance spectroscopy (ESR). Our experiments showed that a tetragonal form of V4+-ZrO2 was the first crystalline phase obtained on heating the gels. On further heating, a phase transformation to the monoclinic form of V4+-ZrO2 took place. Final…