Inorganic Solid Phases

Cs3K2Na4[Cs2K(H2O)7Pd2WO(H2O)(A-α-SiW9O34)2]·5H2O (Cs5K3Na4W19Pd2[SiO4]2O61[H2O]13) Crystal Structure

General Information

  • Phase Label(s): Cs5K3Na4W19Pd2[SiO4]2O61[H2O]13
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mP488
  • Space Group: 14
  • Phase Prototype: Cs5K3Na4W19Pd2[SiO4]2O61[H2O]13
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Rigaku AFC7 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 293 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): orthosilicate, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement on F2; I > 2σ(I), R = 0.052; wR = 0.120
  • Sample Detail(s): sample prepared from Pd(CH3COO)2, Na(CH3COO), K10[A-α-SiW9O34][H2O]24, CsCl, chemical analysis; 57.6 wt.% W, 11.8 wt.% Cs, 3.7 wt.% Pd, 1.9 wt.% K, 1.4 wt.% Na, 1.1 wt.% Si, single crystal (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Cs5K3Na4W19Pd2[SiO4]2O61[H2O]13
  • Alphabetic Formula: Cs5[H2O]13K3Na4O61Pd2[SiO4]2W19
  • Published Formula: Cs3K2Na4[Cs2K(H2O)7Pd2WO(H2O)(A-α-SiW9O34)2]·5H2O
  • Refined Formula: Cs5H30K2.50NaO85Pd2Si2W19
  • Wyckoff Sequence: 14,e122
  • Z Formula Units: 4
  • Density: ρ = 4.67 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]

Anisotropic

Site
U11 [nm2]
U22 [nm2]
U33 [nm2]
U12 [nm2]
U13 [nm2]
U23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1812935

  • 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

    Citation copied