Structure and bonding of Bi4Ir: A difficult-to-access bismuth iridide with a unique framework structure

Research output: Contribution to journalResearch articleContributedpeer-review

Contributors

  • Anna Isaeva - , Chair of Inorganic Chemistry II, TUD Dresden University of Technology (Author)
  • Michael Ruck - , Chair of Inorganic Chemistry II, TUD Dresden University of Technology, Max Planck Institute for Chemical Physics of Solids (Author)
  • Konrad Schäfer - , University of Münster (Author)
  • Ute Ch Rodewald - , University of Münster (Author)
  • Rainer Pöttgen - , University of Münster (Author)

Abstract

Crystals of Bi4Ir, a new intermetallic compound, were obtained by the reaction of an iridium-containing intermetallic precursor with liquid bismuth. X-ray diffraction on a single crystal revealed a rhombohedral structure [R3¯m, a = 2656.7(2) pm, and c = 701.6(4) pm]. Bi4Ir is not isostructural to Bi4Rh but combines motifs of the metastable superconductor Bi14Rh3 with those found in the weak topological insulator Bi14Rh3I9. The two crystallographically independent iridium sites in Bi4Ir have square-prismatic and skewed-square-antiprismatic bismuth coordination with Bi-Ir distances of 283-287 pm. By sharing common edges, the two types of [IrBi8] units constitute a complex three-dimensional network of rings and helices. The bonding in the heterometallic framework is dominated by pairwise Bi-Ir interactions. In addition, three-center bonds are found in the bismuth triangles formed by adjacent [IrBi8] polyhedra. Density functional theory based band-structure calculations suggest metallic properties.

Details

Original languageEnglish
Pages (from-to)885-889
Number of pages5
JournalInorganic chemistry
Volume54
Issue number3
Publication statusPublished - 2 Feb 2015
Peer-reviewedYes

External IDs

ORCID /0000-0002-2391-6025/work/159171914