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混合金属三(二硫化物)硫代磷酸盐,KNb1.77Ta0.23PS10

The mixed-metal tris-(di-sulfide) thio-phosphate, KNb1.77Ta0.23PS10.

作者信息

Lee Yoonjeong, Yoon Woojin, Yun Hoseop

机构信息

Division of Energy Systems Research and Department of Chemistry, Ajou University, Suwon 443-749, Republic of Korea.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Jan 15;70(Pt 2):i8. doi: 10.1107/S1600536814000592. eCollection 2014 Feb 1.

Abstract

The title compound catena-poly[potassium [tri-μ-disulfido-μ-tetra-thiophos-pha-to-di[niobate(IV)/tantalate(IV)(0.885/0.115)]]], has been obtained through the reaction of the elements with KCl. The title compound is isostructural with KNb2PS10, with the Nb sites occupied by statistically disordered Nb (88.5%) and Ta (11.5%) atoms. The structure is composed of anionic ∞ (1)M 2PS10 chains along [100] (M = Nb/Ta) and K(+) ions. This chain is built up from distorted bicapped trigonal prisms [MS8] and [PS4] tetra-hedra. There are no inter-chain bonding inter-actions, except for electrostatic and van der Waals forces. The S2 (2-) and S(2-) anionic species and the M (4+)-M (4+) pair [M-M = 2.8939 (3) Å] are observed. The classical charge balance is represented by [K(+)][M (4+)]2[PS4 (3-)][S2 (2-)]3.

摘要

标题化合物链状聚[钾[三-μ-二硫代-μ-四硫代磷酸根二[铌酸盐(IV)/钽酸盐(IV)(0.885/0.115)]]],是通过元素与氯化钾反应制得的。该标题化合物与KNb2PS10同构,其中铌位点被统计无序的铌(88.5%)和钽(11.5%)原子占据。结构由沿[100]方向的阴离子∞(1)M2PS10链和K(+)离子组成。这条链由扭曲的双帽三棱柱[MS8]和[PS4]四面体构成。除了静电和范德华力外,不存在链间键合相互作用。观察到S2(2-)和S(2-)阴离子物种以及M(4+)-M(4+)对[M-M = 2.8939 (3) Å]。经典的电荷平衡由[K(+)][M(4+)]2[PS4(3-)][S2(2-)]3表示。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4b6/3998242/4bef5a3a872e/e-70-000i8-fig1.jpg

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