Inorganic Solid Phases

Bi2[W(CO)5]3 (W3Bi2[CO]15, T = 238 K) Crystal Structure

General Information

  • Phase Label(s): W3Bi2[CO]15
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: aP70
  • Space Group: 2
  • Phase Prototype: W3Bi2[CO]15
  • Measurement Detail(s): automatic diffractometer; Syntex R3 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of structural parameters), T = 238 K (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): carbonyl
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 2126 reflections; I > 4σ(I), R = 0.041; wR = 0.050
  • Sample Detail(s): sample prepared from BiCl3, Na2W2[CO]10, chemical analysis; Bi and C content analyzed: 30.28 wt.% Bi, 12.75 wt.% C, single crystal (determination of structural parameters)

Substance Summary

  • Standard Formula: W3Bi2[CO]15
  • Alphabetic Formula: Bi2[CO]15W3
  • Published Formula: Bi2[W(CO)5]3
  • Refined Formula: Bi2C15O15W3
  • Wyckoff Sequence: 2,i35
  • Z Formula Units: 2
  • Density: ρ = 3.74 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_1714131

  • 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