Inorganic Solid Phases

Ca₂Fe(OH)₆Cl·2H₂O (Ca₂FeCl[OH]₆[H₂O]₂) Crystal Structure

Get Access CIF Download help (pdf)

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

General Information

Phase Label(s): Ca₂FeCl[OH]₆[H₂O]₂
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: hR36
Space Group: 148
Phase Prototype: Ca₂AlI[OH]₆[H₂O]₂
Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), X-rays, Cu Kα₁; λ = 0.1540598 nm (determination of cell and structural parameters), T = 293 K (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): hydroxide, chloride, hydrate
Interpretation Detail(s): positions of non-H atoms determined, Rietveld refinement, wR_P = 0.0126
Sample Detail(s): powder (determination of cell and structural parameters)

Substance Summary

Standard Formula: Ca₂FeCl[OH]₆[H₂O]₂
Alphabetic Formula: Ca₂ClFe[H₂O]₂[OH]₆
Published Formula: Ca₂Fe(OH)₆Cl·2H₂O
Refined Formula: Ca₂ClFeH₁₀O₈
Wyckoff Sequence: 148,fc²ba
Z Formula Units: 3
Density: ρ = 2.21 Mg·m⁻³

View 3D Interactive Structure

Cite this page

Citation

Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
Space Group	Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial
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.
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Displacement Parameters

Isotropic

Site	Published B [nm²]	Type	Computed B_eq [nm²]
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Experimental Details

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

Reference

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

3D Interactive Structure

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1410354

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 Ca2Fe(OH)6Cl·2H2O (Ca2FeCl[OH]6[H2O]2) Crystal Structure sd_1410354 (Springer-Verlag GmbH, Heidelberg, © 2016)

Download this citation

Citation copied