Inorganic Solid Phases

Cu6(OH)10(SO4)·H2O (Cu6[SO4][OH]10[H2O]) Crystal Structure

General Information

  • Phase Label(s): Cu6[SO4][OH]10[H2O]
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): redgillite
  • Pearson Symbol: mP52
  • Space Group: 14
  • Phase Prototype: Cu6[SO4][OH]10[H2O]
  • Measurement Detail(s): automatic diffractometer; 738 (determination of cell parameters), automatic diffractometer; U.S.A. Illinois, Argonne National Laboratory, Intense Pulsed Neutron Source, GPPD (determination of structural parameters), X-rays, synchrotron; λ = 0.06888 nm (determination of cell and structural parameters), T = 293 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): hydroxide, sulfate, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement on F2; 109 variables; 1529 reflections; I > 2σ(I), R = 0.0896; wR = 0.2375
  • Sample Detail(s): redgillite sample from United Kingdom, England, Cumbria, Golden Hugh level of the Silver Gill vein, electron microprobe analysis; 68.9 wt.% CuO, 11.6 wt.% SO3, single crystal (determination of cell parameters), single crystal, 0.006×0.020×0.070 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Cu6[SO4][OH]10[H2O]
  • Alphabetic Formula: Cu6[H2O][OH]10[SO4]
  • Published Formula: Cu6(OH)10(SO4)·H2O
  • Refined Formula: Cu6H12O15S
  • Wyckoff Sequence: 14,e13
  • Z Formula Units: 2
  • Density: ρ = 3.45 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_1521230

  • 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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