A quarter of a century after its synthesis and with >200 papers based on its use, 'Co(CO3)0.5(OH)•-0.11H2O' proves to be Co6(CO3)2(OH)8•H2O from synchrotron powder diffraction data

被引:29
作者
Bhojane, Prateek [1 ]
Le Bail, Armel [2 ]
Shirage, Parasharam M. [1 ]
机构
[1] Indian Inst Technol Indore, Discipline Met Engn & Mat Sci, Khandwa Rd, Indore 453552, Madhya Pradesh, India
[2] Univ Maine, Inst Mol & Mat Mans, CNRS UMR 6283, Av Olivier Messiaen, F-72085 Le Mans, France
来源
ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY | 2019年 / 75卷
关键词
cobalt(II) carbonate hydroxide hydrate; powder diffraction; ab initio; synchrotron; malachite; CRYSTAL-STRUCTURE; REFINEMENT; CARBONATE;
D O I
10.1107/S2053229618017734
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The successful attempt to solve the crystal structure of Co(CO3)(0.5)(OH)center dot-0.11H(2)O (denoted CCH), based on synchrotron powder diffraction data, leads to a drastic revision of the chemical formula to Co-6(CO3)(2)(OH)(8)center dot H2O [hexacobalt(II) bis(carbonate) octahydroxide monohydrate] and to a hexagonal cell instead of the orthorhombic cell suggested previously [Porta et al. (1992). J. Chem. Soc. Faraday Trans. 88, 311-319]. This results in a new structure-type related to malachite involving infinite chains of [CoO6] octahedra sharing edges along a short c axis, delimiting tunnels having a three-branched star section. All reports discussing cobalt hydroxycarbonates (CCH) without any structural knowledge and especially its topotactic decomposition into Co3O4 have, as a result, to be reconsidered.
引用
收藏
页码:61 / +
页数:7
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