Crystallography Open Database

Information card for entry 4334926

Preview

Coordinates	4334926.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bismuth azide DMSO adduct
Formula	C2 H6 Bi N9 O S
Calculated formula	C2 H6 Bi N9 O S
Title of publication	Solid State Structure of Bi(N3)3, Bi(N3)3.Solvates and the Structural Dynamics in the [Bi(N3)6]3- Anion
Authors of publication	Kati Rosenstengel; Axel Schulz; Alexander Villinger
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	6110 - 6126
a	6.3307 ± 0.0003 Å
b	6.945 ± 0.0003 Å
c	11.5056 ± 0.0005 Å
α	97.979 ± 0.002°
β	103.638 ± 0.002°
γ	104.581 ± 0.002°
Cell volume	465.09 ± 0.04 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0292
Residual factor for significantly intense reflections	0.024
Weighted residual factors for significantly intense reflections	0.0451
Weighted residual factors for all reflections included in the refinement	0.0467
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
179452 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/49.	4334926.cif
100812	2014-02-07	cif/ Adding structures of 4334926 via cif-deposit CGI script.	4334926.cif