Inorganic Solid Phases

(NH4)14[NaP5W30O110]·31H2O (Na[NH4]14W30[PO4]5O90[H2O]31) Crystal Structure

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General Information

  • Phase Label(s): Na[NH4]14W30[PO4]5O90[H2O]31
  • Structure Class(es): –
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: aP331
  • Space Group: 2
  • Phase Prototype: Na[NH4]14W30[PO4]5O90[H2O]31
  • Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Philips PW1100 (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): orthophosphate, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 6341 reflections, R = 0.055
  • Sample Detail(s): chemical analysis; 2.22 wt.% N, 0.29 wt.% Na, 1.77 wt.% P, 65.72 wt.% W, single crystal (determination of cell parameters), single crystal, 0.08×0.08×0.25 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Na[NH4]14W30[PO4]5O90[H2O]31
  • Alphabetic Formula: [H2O]31[NH4]14NaO90[PO4]5W30
  • Published Formula: (NH4)14[NaP5W30O110]·31H2O
  • Refined Formula: H37NaO128.50P5W30
  • Wyckoff Sequence: 2,i165g
  • Z Formula Units: 2
  • Density: ρ = 4.12 Mg·m−3
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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
B [nm2]
Type
Computed
Beq [nm2]

Anisotropic

Site
B11 [nm2]
B22 [nm2]
B33 [nm2]
B12 [nm2]
B13 [nm2]
B23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1935103

  • 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)

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