Inorganic Solid Phases

[Th₂(μ₂-OH)₂Cl₂(H₂O)₁₂]Cl₄·2H₂O (ThCl₃[OH][H₂O]₇) 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): ThCl₃[OH][H₂O]₇
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: aP24
Space Group: 2
Phase Prototype: ThCl₃[OH][H₂O]₇
Measurement Detail(s): automatic diffractometer; 3397 (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), T = 298 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, full-matrix least-squares refinement; 109 variables; 2984 reflections; I > 2σ(I), R = 0.0379; wR = 0.0885
Sample Detail(s): sample prepared from Th[NO₃]₄, NH₄OH, single crystal (determination of cell parameters), single crystal, 0.065×0.125×0.223 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: ThCl₃[OH][H₂O]₇
Alphabetic Formula: Cl₃[H₂O]₇[OH]Th
Published Formula: [Th₂(μ₂-OH)₂Cl₂(H₂O)₁₂]Cl₄·2H₂O
Refined Formula: Cl₃H₁₅O₈Th
Wyckoff Sequence: 2,i¹²
Z Formula Units: 2
Density: ρ = 2.80 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 U [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

Anisotropic

Site	U₁₁ [nm²]	U₂₂ [nm²]	U₃₃ [nm²]	U₁₂ [nm²]	U₁₃ [nm²]	U₂₃ [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_1923073

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 [Th2(μ2-OH)2Cl2(H2O)12]Cl4·2H2O (ThCl3[OH][H2O]7) Crystal Structure sd_1923073 (Springer-Verlag GmbH, Heidelberg, © 2016)

Download this citation

Citation copied