Alkaline earth metal ordering in CaCu9Mg2 and SrCu9Mg2

2020 ◽  
Vol 235 (4-5) ◽  
pp. 137-141
Author(s):  
Maximilian K. Reimann ◽  
Rainer Pöttgen

AbstractThe copper-rich intermetallic compounds CaCu9Mg2 and SrCu9Mg2 were synthesized by induction melting of the elements and subsequent annealing in a muffle furnace. CaCu9Mg2 and SrCu9Mg2 crystallize with the TbCu9Mg2 type structure, space group P 63/mmc, which is a ternary ordered variant of CeNi3. The polycrystalline samples were characterized through their X-ray powder patterns. The CaCu9Mg2 structure was refined from single-crystal X-ray diffraction data. a = 504.13(9), c = 1622.5(3) pm, wR2 = 0.0635, 302 F2 values and 19 variables. The two striking coordination polyhedra in the CaCu9Mg2 structure are Ca@Cu18Mg2 and Mg@Cu12Mg3Ca. These polyhedra condense to layers which are stacked in ABA′B′ sequence. The X-ray data give no hint for Ca/Mg mixing.

Author(s):  
Igor Oshchapovsky ◽  
Volodymyr Pavlyuk ◽  
Grygoriy Dmytriv ◽  
Alexandra Griffin

The structure of lanthanum tetrazinc, LaZn4, has been determined from single-crystal X-ray diffraction data for the first time, approximately 70 years after its discovery. The compound exhibits a new structure type in the space groupCmcm, with one La atom and two Zn atoms occupying sites withm2msymmetry, and one Zn atom occupying a site with 2.. symmetry. The structure is closely related to the BaAl4, La3Al11, BaNi2Si2and CaCu5structure types, which can be presented as close-packed arrangements of 18-vertex clusters, in this case LaZn18. The kindred structure types contain related 18-vertex clusters around atoms of the rare earth or alkaline earth metal.


2010 ◽  
Vol 65 (9) ◽  
pp. 1077-1083 ◽  
Author(s):  
Christine Walbaum ◽  
Ingo Pantenburg ◽  
Gerd Meyer

Salts of alkaline earth metal cations sequestered in dibenzo-18-crown-6 (Db18c6) and benzo-15- crown-5 (B15c5), respectively, with I5−, I7− and I82− as the anions, have been synthesized and their crystal structures determined by single-crystal X-ray diffraction. [Ca(Db18c6)(H2O)3](I5)2- (Db18c6)(H2O) (1): monoclinic, P21 (no. 4), a = 1322.1(2), b = 1849.1(2), c = 1344.0(2) pm, β = 114.70(1)◦, V = 2985.2(6) × 106 pm3, Z = 2; [Sr(B15c5)2](I7)2 (2): triclinic, P1 (no. 2), a = 973.9(5), b = 1244.0(5), c = 1293.3(5) pm, α = 115.28(1), β = 90.18(1), γ = 104.57(1)◦, V = 1360.2(10) × 106 pm3, Z = 2; [Ba(Db18c6)2]I8 (3): orthorhombic, Pbcn (no. 60), a = 1452.0(2), b = 1924.6(2), c = 1912.1(2) pm, V = 5343.3(10) × 106 pm3, Z = 4. Compound 1 contains two crystallographically independent V-shaped pentaiodide anions, I5 −, which are linked to dimers by weak interionic contacts. The unusual heptaiodide anion, I7−, in 2 can be described as a V-shaped pentaiodide unit, which is connected to a slightly widened iodine molecule to give the rare Z form. Secondary bonding distances lead to almost planar ten-membered iodine rings, which are connected through common edges to form ribbons with staircase-like folding. 3 is built of sandwich-like cations and centrosymmetric octaiodide anions, I82−. An inspection for secondary contacts reveals that the iodine substructure of 3 consists of essentially isolated octaiodide units.


1976 ◽  
Vol 31 (12) ◽  
pp. 1604-1606 ◽  
Author(s):  
Hk. Müller-Buschbaum ◽  
W. Schmachtel

Mixed crystals of the formulae CaGaAlO4 (1) and CaGa0.5Al1.5O4 (2) were investigated by X-ray single crystal work. 1 shows a tetrahedral orientation like that of CaGa2O4 (monokl.), 2 another one of CaAl2O4. A discussion of the different polyhedral arrangement of the stuffed tridymite structures is given.


2017 ◽  
Vol 72 (7) ◽  
pp. 511-515 ◽  
Author(s):  
Sebastian Stein ◽  
Lukas Heletta ◽  
Rainer Pöttgen

AbstractGdCuMg has been synthesized by induction-melting of the elements in a sealed niobium ampoule followed by annealing in a muffle furnace. The sample was studied by powder and single crystal X-ray diffraction: ZrNiAl type, P6̅2m (a=749.2(4), c=403.3(1) pm), wR2=0.0242, 315 F2 values and 15 variables. Temperature dependent magnetic susceptibility measurements have revealed an experimental magnetic moment of 8.54(1) μB per Gd atom. GdCuMg orders ferromagnetically below TC=82.2(5) K and based on the magnetization isotherms it can be classified as a soft ferromagnet.


2018 ◽  
Vol 233 (9-10) ◽  
pp. 607-613 ◽  
Author(s):  
Sebastian Stein ◽  
Rainer Pöttgen

Abstract Six new rare earth metal-rich intermetallic compounds RE9CoMg4 with RE=Y, Dy, Ho, Er, Tm and Lu were synthesized by induction-melting the elements in sealed niobium ampoules followed by annealing in muffle furnaces. The structures of Y9CoMg4 and Tm8.56CoMg4.44 were refined from single-crystal X-ray diffraction data: P63/mmc, a=965.65(6), c=971.07(5) pm, wR2=0.0599, 614 F2 values, 20 variables for Y9CoMg4 and a=945.20(4), c=953.11(5) pm, wR2=0.0358, 585 F2 values, 21 variables for Tm8.56CoMg4.44 (a small homogeneity range results from Tm/Mg mixing). The RE9CoMg4 phases crystallize with a coloring variant of the aristotype Co2Al5. The striking structural motif is a hexagonal rod packing of rows of corner- and face-sharing tetrahedral Mg4 clusters with Mg–Mg distances ranging from 304 to 317 pm in Y9CoMg4. These rows are similar to the hexagonal Laves phases REMg2. The space between the rows is filled with rows of face-sharing Co@Y6 trigonal prisms (TP) and empty Y6 octahedra (O) in the sequence –TP–O–O–. The many isopointal coloring variants of the aristotype Co2Al5 are briefly discussed.


Author(s):  
Jeffrey A. Rood ◽  
Ashley L. Huttenstine ◽  
Zachery A. Schmidt ◽  
Michael R. White ◽  
Allen G. Oliver

Reaction of alkaline earth metal salts with diphenylphosphinic acid in dimethylformamide solvent afforded four coordination polymers: [Mg3(O2PPh2)6(DMF)2]·2DMF (I), [Ca(O2PPh2)2(DMF)2] (II), [Sr(O2PPh2)2(DMF)2] (III) and [Ba(O2PPh2)2(DMF)2] (IV) (where DMF isN,N-dimethylformamide). Single-crystal X-ray diffraction revealed that all four compounds produce linear chain structures in the solid state, with the Ca, Sr and Ba forming isostructural crystals. The bulk materials were characterized by FT–IR and1H NMR spectroscopy and elemental analyses.


1991 ◽  
Vol 56 (7) ◽  
pp. 1454-1460 ◽  
Author(s):  
Jaroslav Podlaha ◽  
Jana Podlahová

The crystal structure of the title compound containing a phosphorus analogue of EDTA as the ligand was determined from single-crystal X-ray diffraction data and refined to R = 0.028 for 1 920 observed reflections. The crystals are monocyclic, space group P21/c,a = 8.6169(8), b = 16.0539(9), c = 8.2504(6)Å, β = 103.458(7)° and Z = 2. The structure is completely different from that of the nitrogen prototype, [CdEDTA]2-. It consists of double-stranded polymeric layers which are composed of metal coordination polyhedra linked by μ6-hexadentate ligands; the layers lie parallel to the bc plane and are joined along the a axis through hydrogen bonding donated by water molecules. Because of steric requirements of phosphorus, the coordination polyhedron around Cd is greatly distorted and can best be described as a 5 + 3 type. One P atom, two oxygen atoms from two monodentate carboxylate groups and two water molecules form an approximate trigonal bipyramid and further three more remote carboxylate oxygens complete the arrangement, resulting in an O7P distorted bicapped trigonal prism.


1998 ◽  
Vol 547 ◽  
Author(s):  
Duncan H. Gregory ◽  
Marten G. Barker ◽  
Daniel J. Siddons ◽  
Peter P. Edwards ◽  
Marcin Slaski

AbstractThe ternary transition metal nitrides of general formulation AMN2 (A = alkaline earth metal, M = transition metal) have been systematically studied. These compounds have been synthesised by high temperature solid state reaction from their component binary nitrides in sealed systems. The structures of these materials have been determined by powder X-ray diffraction (PXD) and two layered structure-types (α-NaFeO2-type and KCoO2-type) have been observed, thus far. Intriguingly, magnetic measurements performed on nitride samples indicate they may not be diamagnetic (d = 0, S = 0) as their nominal stoichiometry suggests.


1979 ◽  
Vol 34 (6) ◽  
pp. 886-887 ◽  
Author(s):  
Hans G. Kraft ◽  
Bernd M. Rode

The preparation of two new alkaline earth metal complexes with acetylacetone, where the latter acts as a ligand in its diketoform, is described. The solid compounds are characterized by elemental analysis, IR spectra and X-ray diffraction patterns.


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