Crystallography Open Database

Information card for entry 2022874

2022873 << 2022874 >> 2022875

Preview

Coordinates	2022874.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cesium Tetraiodide
Chemical name	dicesium octaiodide
Formula	Cs I4
Calculated formula	Cs I4
Title of publication	Deformation of polyiodides in Cs2I8 crystals at high pressure
Authors of publication	Poreba, Tomasz; Garbarino, Gaston; Comboni, Davide; Mezouar, Mohamed
Journal of publication	Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials
Year of publication	2021
Journal volume	77
Journal issue	6
Pages of publication	934 - 939
a	10.2847 ± 0.0009 Å
b	8.9809 ± 0.0001 Å
c	11.21 ± 0.0004 Å
α	90°
β	114.598 ± 0.007°
γ	90°
Cell volume	941.46 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0373
Residual factor for significantly intense reflections	0.0317
Weighted residual factors for significantly intense reflections	0.0835
Weighted residual factors for all reflections included in the refinement	0.0898
Goodness-of-fit parameter for all reflections included in the refinement	0.986
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.41077 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
286863 (current)	2023-10-10	cif/ hkl/ Adding structures of 2022874, 2022875, 2022876, 2022877, 2022878, 2022879, 2022880, 2022881, 2022882, 2022883, 2022884, 2022885, 2022886, 2022887 via cif-deposit CGI script.	2022874.cif