Inorganic Solid Phases

N₅S₃Se·AsF₆ (AsSeS₃N₅F₆) Crystal Structure

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General Information

Phase Label(s): AsSeS₃N₅F₆
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: mP64
Space Group: 7
Phase Prototype: AsSeS₃N₅F₆
Measurement Detail(s): automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of structural parameters), T = 293 K (determination of structural parameters)
Phase Class(es): –
Compound Class(es): fluoride, sulfide
Interpretation Detail(s): complete structure determined, least-squares refinement; 238 variables; 1897 reflections; I > 2σ(I), R = 0.065; wR = 0.059
Sample Detail(s): sample prepared from N₂SSeTiCl₄, SO₂, AsF₅, chemical analysis; As_1.54F_9.11N_83.21S_4.65Se_1.49; As, F, N, S and Se content analyzed, single crystal, 0.15×0.32×0.33 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: AsSeS₃N₅F₆
Alphabetic Formula: AsF₆N₅S₃Se
Published Formula: N₅S₃Se·AsF₆
Refined Formula: AsF₆N₅S₃Se
Wyckoff Sequence: 7,a³²
Z Formula Units: 4
Density: ρ = 2.87 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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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_1712679

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 N5S3Se·AsF6 (AsSeS3N5F6) Crystal Structure sd_1712679 (Springer-Verlag GmbH, Heidelberg, © 2016)

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