Inorganic Solid Phases

Hg(OHg)4Br2 (Hg5Br2O4) Crystal Structure

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General Information

  • Phase Label(s): Hg5Br2O4
  • Structure Class(es): –
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: oI44
  • Space Group: 72
  • Phase Prototype: Hg5Cl2O4
  • Measurement Detail(s): Guinier film (determination of cell parameters), Weissenberg photographs (determination of structural parameters), X-rays, Cu Kα1 (determination of cell parameters), X-rays, Cu Kα (determination of structural parameters)
  • Phase Class(es): –
  • Compound Class(es): bromide, oxide
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 383 reflections, R = 0.105
  • Sample Detail(s): sample prepared from HgBr2, HgO, chemical analysis; 81.81 wt.% Hg, 13.26 wt.% Br, powder (determination of cell parameters), single crystal, 0.01×0.04×0.06 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Hg5Br2O4
  • Alphabetic Formula: Br2Hg5O4
  • Published Formula: Hg(OHg)4Br2
  • Refined Formula: Br2Hg5O4
  • Wyckoff Sequence: 72,kj2ga
  • Z Formula Units: 4
  • Density: ρ = 9.44 Mg·m−3
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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

Isotropic

Site
Published
B [nm2]
Type
Computed
Beq [nm2]

Powder Pattern

published defraction line
sin2(θ) [10−4]
computed diffraction line for Cu Kα
d [nm]
intensity
I [1]
h [1]
k [1]
l [1]
Radiation
Remark

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1816346

  • 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)

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