Crystallography Open Database

Information card for entry 3000225

Preview

Coordinates	3000225.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	potassium chlorate(V)
Formula	Cl K O3
Calculated formula	Cl K O3
Title of publication	On Potassiumchlorate, K Cl O3, Rubidiumchlorate, Rb Cl O3, and Cesiumchlorat, Cs Cl O3 . I. Crystal structure of twinned K Cl O3 at 415 K
Authors of publication	Reiner, G.; Wartchow, R.
Journal of publication	Institutionelles Repositorium der Leibniz Universitaet Hannover
Year of publication	2019
a	4.684 ± 0.001 Å
b	5.614 ± 0.001 Å
c	13.528 ± 0.003 Å
α	90°
β	90 ± 0.02°
γ	90°
Cell volume	355.73 ± 0.13 Å³
Cell temperature	415 ± 5 K
Ambient diffraction temperature	415 ± 5 K
Number of distinct elements	3
Space group number	11
Hermann-Mauguin space group symbol	B 1 21/m 1
Hall space group symbol	-P 2yb (1/2x,y,-1/2x+z)
Residual factor for all reflections	0.0342
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0733
Weighted residual factors for all reflections included in the refinement	0.0754
Goodness-of-fit parameter for all reflections included in the refinement	1.098
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
214825 (current)	2019-04-29	cif/ Updating files of 3000225 Original log message: Releasing structure 3000225 into public domain as published material per request from Rudolf Wartchow.	3000225.cif
214342	2019-03-26	cif/ Adding structures of 3000225 via cif-deposit CGI script.	3000225.cif