Crystallography Open Database

Information card for entry 2312404

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Coordinates	2312404.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Dicadmium orthophosphate hydroxide
Formula	Cd2 H O5 P
Calculated formula	Cd2 O5 P
Title of publication	Cadmium phosphates Cd<sub>2</sub>(PO<sub>4</sub>)OH and Cd<sub>5</sub>(PO<sub>4</sub>)<sub>2</sub>(OH)<sub>4</sub> crystallizing in mineral structures.
Authors of publication	Eder, Felix; Weil, Matthias
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2024
Journal volume	80
Journal issue	Pt 2
Pages of publication	207 - 212
a	12.4307 ± 0.0013 Å
b	6.691 ± 0.0006 Å
c	10.7087 ± 0.001 Å
α	90°
β	107.506 ± 0.003°
γ	90°
Cell volume	849.43 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0847
Residual factor for significantly intense reflections	0.0465
Weighted residual factors for significantly intense reflections	0.0852
Weighted residual factors for all reflections included in the refinement	0.0996
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
290315 (current)	2024-03-05	cif/ Adding structures of 2312404, 2312405 via cif-deposit CGI script.	2312404.cif