Inorganic Solid Phases

[Co(NH3)5NO]2Br2.56(NO3)1.44·H2O (Co2Br2.56[NO3]1.44[NO]2[NH3]10[H2O]2) Crystal Structure

General Information

  • Phase Label(s): Co2Br2.56[NO3]1.44[NO]2[NH3]10[H2O]2
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mS116
  • Space Group: 12
  • Phase Prototype: Co2Br2.56[NO3]1.44[NO]2[NH3]10[H2O]2
  • Measurement Detail(s): Weissenberg photographs (determination of cell parameters), oscillation and Weissenberg photographs (determination of structural parameters), X-rays, Cu Kα; λ = 0.15418 nm (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): nitrate, bromide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, least-squares refinement; 1264 reflections, R = 0.134; wR = 0.17
  • Sample Detail(s): sample prepared from Co3+[NH3]5NO[NO3]2 red, KBr, single crystal (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Co2Br2.56[NO3]1.44[NO]2[NH3]10[H2O]2
  • Alphabetic Formula: Br2.56Co2[H2O]2[NH3]10[NO]2[NO3]1.44
  • Published Formula: [Co(NH3)5NO]2Br2.56(NO3)1.44·H2O
  • Refined Formula: Br2.56Co2H34N13.44O8.32
  • Wyckoff Sequence: 12,j5i19
  • Z Formula Units: 4
  • Density: ρ = 2.02 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]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1905858

  • 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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