Inorganic Solid Phases

[Cd(OS3N2)6][AsF6]2 (CdAs2S18N12O6F12) Crystal Structure

General Information

  • Phase Label(s): CdAs2S18N12O6F12
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: aP51
  • Space Group: 2
  • Phase Prototype: CdAs2S18N12O6F12
  • Measurement Detail(s): automatic diffractometer; 23 (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4F (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): fluoride, oxide
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 2312 reflections; I > 2σ(I), R = 0.057; wR = 0.057
  • Sample Detail(s): sample prepared from Cd[SO2]2[AsF6]2, OS3N2, chemical analysis; 16.0 wt.% F, 11.6 wt.% N, 39.5 wt.% S, single crystal (determination of cell parameters), single crystal, 0.20×0.25×0.35 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: CdAs2S18N12O6F12
  • Alphabetic Formula: As2CdF12N12O6S18
  • Published Formula: [Cd(OS3N2)6][AsF6]2
  • Refined Formula: As2CdF12N12O6S18
  • Wyckoff Sequence: 2,i25f
  • Z Formula Units: 1
  • Density: ρ = 2.40 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_1004488

  • 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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