Crystallography Open Database

Information card for entry 2006360

2006359 << 2006360 >> 2006361

Preview

Coordinates	2006360.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Bis(Tetra(thf))lithium(I) Tetrachloro di(μ-chloro) bis(thf)dibismuthate(III)
Formula	C20 H40 Bi Cl4 Li O5
Calculated formula	C20 H40 Bi Cl4 Li O5
SMILES	[Bi]1([O]2CCCC2)(Cl)(Cl)(Cl)[Cl][Bi]([O]2CCCC2)(Cl)(Cl)(Cl)[Cl]1.[Li]([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1.[Li]([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1
Title of publication	Tetrahydrofuran Adducts of a Chlorobismuthate(III) Anion and Antimony Triiodide
Authors of publication	James, Sian C.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.
Journal of publication	Acta Crystallographica Section C
Year of publication	1997
Journal volume	53
Journal issue	8
Pages of publication	1024 - 1027
a	10.598 ± 0.002 Å
b	24.577 ± 0.003 Å
c	11.378 ± 0.004 Å
α	90°
β	104.24 ± 0.02°
γ	90°
Cell volume	2872.5 ± 1.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1236
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for all reflections	0.0863
Weighted residual factors for significantly intense reflections	0.0716
Goodness-of-fit parameter for all reflections	0.854
Goodness-of-fit parameter for significantly intense reflections	0.994
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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