Crystallography Open Database

Information card for entry 3000227

Preview

Coordinates	3000227.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	rubidium chlorate(V)
Formula	Cl O3 Rb
Calculated formula	Cl O3 Rb
Title of publication	On Potassiumchlorate, K Cl O3, Rubidiumchlorate, Rb Cl O3, and Cesiumchlorate, Cs Cl O3 . III. Crystal structure of high-temperature Rb Cl O3
Authors of publication	Reiner, G.; Wartchow, R.
Journal of publication	Institutionelles Repositorium der Leibniz Universitaet Hannover
Year of publication	2019
a	9.367 ± 0.003 Å
b	5.894 ± 0.001 Å
c	7.61 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	420.14 ± 0.19 Å³
Cell temperature	600 ± 10 K
Ambient diffraction temperature	600 ± 10 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0745
Residual factor for significantly intense reflections	0.0556
Weighted residual factors for significantly intense reflections	0.0883
Weighted residual factors for all reflections included in the refinement	0.0978
Goodness-of-fit parameter for all reflections included in the refinement	1.493
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
214850 (current)	2019-04-30	cif/3/00/02/ Marking disorder in entry 3000227 after discussing it with its author.	3000227.cif
214827	2019-04-29	cif/ Updating files of 3000227 Original log message: Releasing structure 3000227 into public domain as published material per request from Rudolf Wartchow.	3000227.cif
214344	2019-03-26	cif/ Adding structures of 3000227 via cif-deposit CGI script.	3000227.cif