Die Kristallstruktur von Tl3Bi2I9: Eine komplexe Ausdünnungs- und Verzerrungsvariante des Perowskit-Typs

Publikation: Beitrag in FachzeitschriftForschungsartikelBeigetragenBegutachtung

Beitragende

Abstract

Black crystals of trithallium(I) enneaiododibismuthate(III) Tl 3Bi2I9 were obtained by slow cooling of a melt with composition Tl:Bi:I = 3:2:9 from 800 K to ambient temperature. The compound is diamagnetic and decomposes peritectically at 619(2) K. X-ray diffraction of single-crystals revealed that Tl3Bi2I9 crystallizes in the monoclinic space group P21ln with lattice parameters a = 1438.9(1), b = 771.54(7), c = 2091.0(1)pm and β = 93.309(6)°, (Z = 4). The crystal structure can be described as a defect variant of the perovskite type (ABX3), where according to the formula Tl(Bi2/3□J1/3)I3 the Bi atoms occupy only two thirds of the octahedral sites B. The vacancies are located in every third plane resulting in double layers of corner sharing [BiI6] polyhedra. By distortion and rotation of the [BiI6] polyhedra the coordination of the Tl atoms (cuboctahedral sites in the perovskite type, c.n. = 12) is reduced to bicapped trigonal prisms (c.n. = 8). The group-subgroup relation between the Tl3Bi2I9 structure and the perovskite type results in a subgroup index of 144.

Details

OriginalspracheDeutsch
Seiten (von - bis)1055-1059
Seitenumfang5
FachzeitschriftZeitschrift fur Anorganische und Allgemeine Chemie
Jahrgang631
Ausgabenummer6-7
PublikationsstatusVeröffentlicht - 2005
Peer-Review-StatusJa

Externe IDs

ORCID /0000-0002-2391-6025/work/166325865

Schlagworte

ASJC Scopus Sachgebiete

Schlagwörter

  • Bismuth, Group-subgroup relations, Halide, Perovskite type, Thallium