Inorganic Solid Phases

S2Co4(CO)10 (Co2S[CO]5) Crystal Structure

General Information

  • Phase Label(s): Co2S[CO]5
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mP52
  • Space Group: 14
  • Phase Prototype: Co2S[CO]5
  • Measurement Detail(s): precession and Weissenberg photographs (determination of cell and structural parameters), X-rays, Mo Kα; λ = 0.07107 nm (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): carbonyl, sulfide
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; F > 0σ(F), R = 0.092; wR = 0.072
  • Sample Detail(s): sample prepared from hydrogen sulfide, dicobalt octacarbonyl, single crystal (determination of cell parameters), single crystal, 0.05×0.20×0.31 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Co2S[CO]5
  • Alphabetic Formula: [CO]5Co2S
  • Published Formula: S2Co4(CO)10
  • Refined Formula: C5Co2O5S
  • Wyckoff Sequence: 14,e13
  • Z Formula Units: 4
  • Density: ρ = 2.28 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
B [nm2]
Type
Computed
Beq [nm2]

Anisotropic

Site
β11 [nm2]
β22 [nm2]
β33 [nm2]
β12 [nm2]
β13 [nm2]
β23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1200265

  • 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