Inorganic Solid Phases

[Na1.41Ca0.07H2O1.48][Na5.65K0.35(CO3)1−x(C2O4)x][Si6.5Al5.5O24] (x≤ 1); K0.36Na7.14Ca0.07B0.01(Si6.5Al5.5O24)·(CO3)1.0Cl0.03(SO4)0.03(H2O)~1 (K0.35Na7.06Ca0.07Al5.5Si6.5[CO3]O24[H2O]1.48) Crystal Structure

General Information

  • Phase Label(s): K0.35Na7.06Ca0.07Al5.5Si6.5[CO3]O24[H2O]1.48
  • Structure Class(es): zeolite CAN
  • Classification by Properties:
  • Mineral Name(s): kyanoxalite
  • Pearson Symbol: hP78
  • Space Group: 173
  • Phase Prototype: K0.35Na7.06Ca0.07(Al0.92Si0.08)6[SiO4]6[CO3][H2O]1.48
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Bruker AXS SMART (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): carbonate, silicate, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement
  • Sample Detail(s): oxalate-bearing cancrinite sample from Russia, Kola Peninsula, Kovdor massif, single crystal (determination of cell parameters), single crystal, 0.2×0.2×0.2 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: K0.35Na7.06Ca0.07Al5.5Si6.5[CO3]O24[H2O]1.48
  • Alphabetic Formula: Al5.5[CO3]Ca0.07[H2O]1.48K0.35Na7.06O24Si6.5
  • Published Formula: [Na1.41Ca0.07H2O1.48][Na5.65K0.35(CO3)1−x(C2O4)x][Si6.5Al5.5O24] (x≤ 1); K0.36Na7.14Ca0.07B0.01(Si6.5Al5.5O24)·(CO3)1.0Cl0.03(SO4)0.03(H2O)~1
  • Refined Formula: Al6CCa0.07H3K0.32Na7.14O28.50Si6
  • Wyckoff Sequence: 173,c12ba2
  • Z Formula Units: 1
  • Density: ρ = 2.25 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_1628862

  • 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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