Inorganic Solid Phases

(NH4)10[Mo6+11V5+5V4+2O529-SO3)(Mo6+6V5+O22)]·14H2O ([NH4]10V8Mo17[SO3]O74[H2O]14, T = 150(2) K) Crystal Structure

General Information

  • Phase Label(s): [NH4]10V8Mo17[SO3]O74[H2O]14
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oP536
  • Space Group: 62
  • Phase Prototype: [NH4]10V4(V0.44Mo0.56)9Mo12[SO3]O74[H2O]14
  • Measurement Detail(s): automatic diffractometer; 9251 (determination of cell parameters), automatic diffractometer (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 150(2) K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): sulfite, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 552 variables; 5446 reflections; I > 2σ(I), R = 0.0544; wR = 0.1414
  • Sample Detail(s): sample prepared from [NH4]6Mo7O24[H2O]4, NH4VO3, [NH4]2SO3, HCl, chemical analysis; 43.98 wt.% Mo, 10.95 wt.% V, single crystal (determination of cell parameters), single crystal, 0.08×0.10×0.16 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: [NH4]10V8Mo17[SO3]O74[H2O]14
  • Alphabetic Formula: [H2O]14Mo17[NH4]10O74[SO3]V8
  • Published Formula: (NH4)10[Mo6+11V5+5V4+2O529-SO3)(Mo6+6V5+O22)]·14H2O
  • Refined Formula: H70.20Mo17N10O92.10SV8
  • Wyckoff Sequence: 62,d56c22
  • Z Formula Units: 4
  • Density: ρ = 2.83 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_1930503

  • 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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