Inorganic Solid Phases

Co5(OD)6(SO4)2(D2O)4 (Co5[SO4]2[OD]6[D2O]4, T = 18 K) Crystal Structure

General Information

  • Phase Label(s): Co5[SO4]2[OD]6[D2O]4
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mP50
  • Space Group: 14
  • Phase Prototype: Co5[SO4]2[OH]6[H2O]4
  • Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), neutrons; λ = 0.24266 nm (determination of cell and structural parameters), T = 18 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): hydroxide-D, sulfate, hydrate-D
  • Interpretation Detail(s): complete structure determined, Rietveld refinement; 80 variables, RP = 0.147; wRP = 0.136; RB = 0.0384
  • Sample Detail(s): sample prepared from CoSO4[D2O]7, NaOH, single crystal (determination of cell parameters), powder (determination of structural parameters)

Substance Summary

  • Standard Formula: Co5[SO4]2[OD]6[D2O]4
  • Alphabetic Formula: Co5[D2O]4[OD]6[SO4]2
  • Published Formula: Co5(OD)6(SO4)2(D2O)4
  • Refined Formula: Co5D12.82H1.18O18S2
  • Wyckoff Sequence: 14,e12a
  • Z Formula Units: 2
  • Density: ρ = 3.16 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1621602

  • 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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