Inorganic Solid Phases

Na13[(Se2W12O46)2{Mn2Cl(H2O)2}{Mn(H2O)2(SeO)}2]·51H2O (Na2') (Na13W24Mn4[SeO3]6ClO76[H2O]57, T = 100.0(2) K) Crystal Structure

General Information

  • Phase Label(s): Na13W24Mn4[SeO3]6ClO76[H2O]57
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: aP225
  • Space Group: 2
  • Phase Prototype: Na13W24Mn4[SeO3]6ClO76[H2O]57
  • Measurement Detail(s): automatic diffractometer; 8432 (determination of cell parameters), automatic diffractometer; Bruker AXS APEX DUO (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell parameters), X-rays, Mo Kα (determination of structural parameters), T = 100.0(2) K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): trioxoselenate(IV), chloride, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 22796 reflections; I > 2σ(I)
  • Sample Detail(s): sample prepared from SeO2, Na2WO4[H2O]2, HCl, MnCl2[H2O]4, chemical analysis, single crystal (determination of cell parameters), single crystal, 0.06×0.08×0.12 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Na13W24Mn4[SeO3]6ClO76[H2O]57
  • Alphabetic Formula: Cl[H2O]57Mn4Na13O76[SeO3]6W24
  • Published Formula: Na13[(Se2W12O46)2{Mn2Cl(H2O)2}{Mn(H2O)2(SeO)}2]·51H2O (Na2')
  • Refined Formula: ClH114Mn4Na13O151Se6W24
  • Wyckoff Sequence: 2,i112d
  • Z Formula Units: 1
  • Density: ρ = 3.85 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

Isotropic

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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1638685

  • 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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