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Synthesis and Structure of Ba(2)Sn(3)Sb(6), a Zintl Phase Containing Channels and Chains
1Department of Chemistry, University of Alberta, Edmonton, Alberta, Canada T6G 2G2.
Abstract:
The new Zintl phase dibarium tritin hexaantimonide, Ba(2)Sn(3)Sb(6) has been synthesized, and its structure has been determined by single-crystal X-ray diffraction methods. It crystallizes in the orthorhombic space group -Pnma with a = 13.351(1) Å, b = 4.4100(5) Å, c = 24.449(3) Å, and Z = 4 (T = -50 degrees C). The structure of Ba(2)Sn(3)Sb(6) comprises large channels [010] defined by 30-membered rings constructed from an anionic framework. This framework is built up from Sn-centered trigonal pyramids and tetrahedra, as well as zigzag chains of Sb atoms. Within the channels reside the Ba(2+) cations and additional isolated zigzag Sb-Sb chains. The simultaneous presence of Sn trigonal pyramids and tetrahedra implies that Ba(2)Sn(3)Sb(6) is a mixed-valence compound whose oxidation state notation can be best represented as (Ba(2+))(2)[(Sn(II))(2)(Sn(IV))(Sb(-)(III))(3)(Sb(-)(I))](2)(-)[(Sb(-)(I))(2)](2)(-).
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