Inorganic Solid Phases

Cd₄₆Si₁₀₀Al₉₂O₃₈₄·52S; Cd²⁺-exchanged zeolite X (Cd_11.5Al₂₃Si₂₅S₁₃O₉₆) Crystal Structure

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General Information

Phase Label(s): Cd_11.5Al₂₃Si₂₅S₁₃O₉₆
Structure Class(es): zeolite FAU
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: cF1232
Space Group: 203
Phase Prototype: Cd_11.5(Al_0.96Si_0.04)₂₄[SiO₄]₂₄S₁₃
Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters), T = 294(1) K (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): silicate, sulfide
Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 87 variables; 362 reflections; I > 3σ(I), R = 0.051; wR = 0.043
Sample Detail(s): sample prepared from Na₉₂Si₁₀₀Al₉₂O₃₈₄, Cd[NO₃]₂, Cd(O₂CCH₃)₂, single crystal (determination of cell and structural parameters)

Substance Summary

Standard Formula: Cd_11.5Al₂₃Si₂₅S₁₃O₉₆
Alphabetic Formula: Al₂₃Cd_11.5O₉₆S₁₃Si₂₅
Published Formula: Cd₄₆Si₁₀₀Al₉₂O₃₈₄·52S; Cd²⁺-exchanged zeolite X
Refined Formula: Al₂₄Cd_11.50O₉₆S_12.97Si₂₄
Wyckoff Sequence: 203,g¹¹e⁵c
Z Formula Units: 4
Density: ρ = 1.96 Mg·m⁻³

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Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
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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.
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Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
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Displacement Parameters

Isotropic

Site	Published U [nm²]	Type	Computed B_eq [nm²]
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Anisotropic

Site	U₁₁ [nm²]	U₂₂ [nm²]	U₃₃ [nm²]	U₁₂ [nm²]	U₁₃ [nm²]	U₂₃ [nm²]
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Experimental Details

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Reference

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3D Interactive Structure

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About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1938289

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.

Project Coordinator: Shuichi Iwata

Section-Editor: Karin Cenzual (Crystal Structures)

Cite this content

Pierre Villars (Chief Editor), PAULING FILE in: Inorganic Solid Phases, SpringerMaterials (online database), Springer, Heidelberg (ed.) SpringerMaterials Cd46Si100Al92O384·52S; Cd2+-exchanged zeolite X (Cd11.5Al23Si25S13O96) Crystal Structure sd_1938289 (Springer-Verlag GmbH, Heidelberg, © 2016)

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Cd46Si100Al92O384·52S; Cd2+-exchanged zeolite X (Cd11.5Al23Si25S13O96) Crystal Structure

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General Information

Substance Summary

Cite this page

Crystallographic Data

Cell Parameters

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Atom Coordinates

Standardized

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Published

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Displacement Parameters

Isotropic

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Anisotropic

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Experimental Details

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Reference

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3D Interactive Structure

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About this content

Cite this content

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Cd₄₆Si₁₀₀Al₉₂O₃₈₄·52S; Cd²⁺-exchanged zeolite X (Cd_11.5Al₂₃Si₂₅S₁₃O₉₆) Crystal Structure