Inorganic Solid Phases

cis-[CoF2(NH3)4]ClO4 (Co[ClO4]F2[NH3]4) Crystal Structure

General Information

  • Phase Label(s): Co[ClO4]F2[NH3]4
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: tP48
  • Space Group: 76
  • Phase Prototype: Co[ClO4]F2[NH3]4
  • Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Rigaku AFC5 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 297(1) K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): perchlorate, fluoride
  • Interpretation Detail(s): positions of non-H atoms determined, block-diagonal least-squares refinement; 970 reflections; F > 3σ(F), R = 0.052; wR = 0.053
  • Sample Detail(s): sample prepared from (Co[NH3]4[H2O]2)[ClO4]3, NH4F, single crystal (determination of cell parameters), single crystal, 0.08×0.08×0.50 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Co[ClO4]F2[NH3]4
  • Alphabetic Formula: [ClO4]CoF2[NH3]4
  • Published Formula: cis-[CoF2(NH3)4]ClO4
  • Refined Formula: ClCoF2H12N4O4
  • Wyckoff Sequence: 76,a12
  • Z Formula Units: 4
  • Density: ρ = 2.05 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_1920303

  • 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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