Inorganic Solid Phases

In(ReO4)3·4.5H2O (In2[ReO4]6[H2O]9, T = 173 K) Crystal Structure

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General Information

  • Phase Label(s): In2[ReO4]6[H2O]9
  • Structure Class(es): –
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: mS164
  • Space Group: 15
  • Phase Prototype: In2[ReO4]6[H2O]9
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Siemens P3/PC (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters), T = 173 K (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): tetraoxorhenate(VII), hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 3543 reflections; I > 2σ(I), R = 0.081
  • Sample Detail(s): sample prepared from In[ReO4]3, gravimetry, inductive coupled plasma method; 12.10 wt.% In, 59.27 wt.% Re, 8.72 wt.% H2O, 19.91 wt.% O, single crystal (determination of cell parameters), single crystal, 0.3×0.3×0.3 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: In2[ReO4]6[H2O]9
  • Alphabetic Formula: [H2O]9In2[ReO4]6
  • Published Formula: In(ReO4)3·4.5H2O
  • Refined Formula: H18In2O33Re6
  • Wyckoff Sequence: 15,f20e
  • Z Formula Units: 4
  • Density: ρ = 4.42 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
U [nm2]
Type
Computed
Beq [nm2]

Powder Pattern

published defraction line
d [Å]
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_1030175

  • 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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