Ab-initio crystal structure of hydroxy adipate of nickel and hydroxy subarate of nickel and cobalt from synchrotron powder diffraction and magnetic properties
- Laboratoire de Chimie du Solide Mineral, UMR 7555, Universite Henri Poincare, F-54506 Vandoeuvre les Nancy (France)
- Laboratoire de Cristallographie et de Modelisation des Materiaux Mineraux et Biologiques, UMR UHP-CNRS no 7036, Universite Henri Poincare, Nancy I, 54506 Vandoeuvre les Nancy (France)
Organic-inorganic hybrid compounds Ni(II){sub 5}(OH){sub 6}(C{sub 6}H{sub 8}O{sub 4}){sub 2}(1), Ni(II){sub 5}(OH){sub 6}(C{sub 8}H{sub 12}O{sub 4}){sub 2}(2) and Co(II){sub 5}(OH){sub 6}(C{sub 8}H{sub 12}O{sub 4}){sub 2}(3) have a similar layered structure as determined ab initio from synchrotron powder diffraction analysis. The metal sites are octahedrally coordinated by O atoms. The slabs are built from edge-sharing octahedra in such a way that channels with an average size of 4 A are formed. Bis-bidentate and bridging dicarboxylate anions lead to a 3D framework. The compounds (1) and (2) order antiferromagnetically below T{sub N}=26.5 and 19.3 K, respectively, while (3) is ferrimagnetic with T{sub C}=16.2 K. Crystal data for compounds are as follows: (1)a=11.6504(1) A, b=6.8021(3) A, c=6.3603(1) A, {alpha}=73.52(1){sup o}, {beta}=99.69(1){sup o}, {gamma}=96.16(1){sup o}, R{sub B}=0.070, 668 reflections; (2)a=13.9325(1) A, b=6.7893(1) A, c=6.3534(4) A, {alpha}=73.63(1){sup o}, {beta}=95.14(1){sup o}, {gamma}=91.80(1){sup o}, R{sub B}=0.052, 804 reflections; (3)a=13.9806(1) A, b=6.9588(1) A, c=6.3967(1) A, {alpha}=73.05(1){sup o}, {beta}=94.51(1){sup o}, {gamma}=92.19(1){sup o}, R{sub B}=0.048, 410 reflections. The space group is P-1 for the three compounds. - Graphical abstract: The hybrid metal-organic compounds Ni(II){sub 5}(OH){sub 6}(C{sub 6}H{sub 8}O{sub 4}){sub 2}(1), Ni(II){sub 5}(OH){sub 6}(C{sub 8}H{sub 12}O{sub 4}){sub 2}(2) and Co(II){sub 5}(OH){sub 6}(C{sub 8}H{sub 12}O{sub 4}){sub 2}(3) have been synthesized by the hydrothermal route. The microporous metal hydroxide layers are bridged by dicarboxylates anions. (1) and (2) are antiferromagnetic with T{sub N}=26.5 and 19.3 K, respectively, while (3) is ferrimagnetic with T{sub C}=16.2 K.
- OSTI ID:
- 21212126
- Journal Information:
- Journal of Solid State Chemistry, Vol. 181, Issue 12; Other Information: DOI: 10.1016/j.jssc.2008.06.059; PII: S0022-4596(08)00437-4; Copyright (c) 2008 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved; Country of input: International Atomic Energy Agency (IAEA); ISSN 0022-4596
- Country of Publication:
- United States
- Language:
- English
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