Inorganic Solid Phases

ClC(O)SNSO (CS[NSO]ClO, T = 125 K) Crystal Structure

General Information

  • Phase Label(s): CS[NSO]ClO
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oP28
  • Space Group: 29
  • Phase Prototype: CS[NSO]ClO
  • Measurement Detail(s): automatic diffractometer; 35 (determination of cell parameters), automatic diffractometer; Nicolet R3m/V (determination of structural parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of cell and structural parameters), T = 125 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): sulfinylamide, chloride, oxide
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement on F; 64 variables; 1432 reflections; F > 4σ(F), R = 0.0325; wR = 0.0370
  • Sample Detail(s): sample prepared from ClC(O)SCl, Hg[NSO]2, single crystal (determination of cell parameters), single crystal, 0.3 mm diameter (determination of structural parameters)

Substance Summary

  • Standard Formula: CS[NSO]ClO
  • Alphabetic Formula: CCl[NSO]OS
  • Published Formula: ClC(O)SNSO
  • Refined Formula: CClNO2S2
  • Wyckoff Sequence: 29,a7
  • Z Formula Units: 4
  • Density: ρ = 2.00 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]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1925186

  • 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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