Crystallography Open Database

Information card for entry 4116198

Preview

Coordinates	4116198.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	cesium_bismuthide
Chemical name	Cs3Bi2
Formula	Bi2 Cs3
Calculated formula	Bi2 Cs3
SMILES	[Bi-][Bi-].[Cs+].[Cs+].[Cs+]
Title of publication	Synthesis and Characterization of A3Bi2 (A = K, Rb, Cs) with Isolated Diatomic Dianion of Bismuth, [Bi2]2-, and an Extra Delocalized Electron
Authors of publication	Franck Gascoin; Slavi C. Sevov
Journal of publication	Journal of the American Chemical Society
Year of publication	2000
Journal volume	122
Pages of publication	10251 - 10252
a	10.078 ± 0.001 Å
b	10.3207 ± 0.0006 Å
c	10.145 ± 0.001 Å
α	90°
β	105.21 ± 0.01°
γ	90°
Cell volume	1018.24 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0693
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.0824
Weighted residual factors for all reflections included in the refinement	0.0909
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178932 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/61.	4116198.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4116198.cif
70777	2013-01-04	cif/ Adding structures of 4116198 via cif-deposit CGI script.	4116198.cif