Inorganic Solid Phases

SiH3(NCO) (H3Si[OCN], T = 138 K) Crystal Structure

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General Information

  • Phase Label(s): H3Si[OCN]
  • Structure Class(es): –
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: oP16
  • Space Group: 62
  • Phase Prototype: H3Si[OCN]
  • Measurement Detail(s): Weissenberg photographs (determination of structural parameters), X-rays, Cu Kα1; λ = 0.15418 nm (determination of structural parameters), T = 138 K (determination of structural parameters)
  • Phase Class(es): –
  • Compound Class(es): (iso)cyanate
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 329 reflections, R = 0.034
  • Sample Detail(s): single crystal (determination of structural parameters)

Substance Summary

  • Standard Formula: H3Si[OCN]
  • Alphabetic Formula: H3[OCN]Si
  • Published Formula: SiH3(NCO)
  • Refined Formula: CH3NOSi
  • Wyckoff Sequence: 62,c4
  • Z Formula Units: 4
  • Density: ρ = 1.32 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1905900

  • 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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