Crystallography Open Database

Information card for entry 3000226

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Structure parameters

Chemical name	potassium chlorate(V) (HTM)
Formula	Cl K O3
Calculated formula	Cl K O3
Title of publication	On Potassiumchlorate, K Cl O3, Rubidiumchlorate, Rb Cl O3, and Cesiumchlorate, Cs Cl O3 . II. Crystal structure of high-temperature K Cl O3 at 296 K
Authors of publication	Reiner, G.; Wartchow, R.
Journal of publication	Institutionelles Repositorium der Leibniz Universitaet Hannover
Year of publication	2019
a	4.65 ± 0.001 Å
b	5.582 ± 0.001 Å
c	13.368 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	346.98 ± 0.11 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P c m n
Hall space group symbol	-P 2n 2ac
Residual factor for all reflections	0.0524
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.0418
Weighted residual factors for all reflections included in the refinement	0.044
Goodness-of-fit parameter for all reflections included in the refinement	1.286
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
301810 (current)	2025-08-19	Add cross-references to PubChem compounds in COD range 3/ Each referenced PubChem compound corresponds to the full crystal structure.	3000226.cif
214826	2019-04-29	cif/ Updating files of 3000226 Original log message: Releasing structure 3000226 into public domain as published material per request from Rudolf Wartchow.	3000226.cif
214343	2019-03-26	cif/ Adding structures of 3000226 via cif-deposit CGI script.	3000226.cif