Inorganic Solid Phases

Hg3S2ClI (Hg3S2ICl) Crystal Structure

General Information

  • Phase Label(s): Hg3S2ICl
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): radtkeite
  • Pearson Symbol: mS56
  • Space Group: 12
  • Phase Prototype: Hg3S2ICl
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): chloride, iodide, sulfide
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 1444 reflections; F > 4σ(F), R = 0.0527
  • Sample Detail(s): radtkeite sample from synthetic, sample prepared from HgS, HgCl2, HgI2, electron microprobe analysis; 74.13 wt.% Hg, 6.75 wt.% S, 4.69 wt.% Cl, 14.80 wt.% I, single crystal (determination of cell parameters), single crystal, 0.08×0.12×0.32 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Hg3S2ICl
  • Alphabetic Formula: ClHg3IS2
  • Published Formula: Hg3S2ClI
  • Refined Formula: ClHg3IS2
  • Wyckoff Sequence: 12,j3i6ge
  • Z Formula Units: 8
  • Density: ρ = 7.13 Mg·m−3

Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation
Co-ord. No.
Atomic Env.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Displacement Parameters

Anisotropic

Site
U11 [nm2]
U22 [nm2]
U33 [nm2]
U12 [nm2]
U13 [nm2]
U23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1321126

  • Copyright

    ©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

  • Chief Editor

    Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

    villars.mpds@bluewin.ch

  • Credits

    SpringerMaterials Release 2016.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

  • Cite this content

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