Crystallography Open Database

Information card for entry 7704133

Preview

Coordinates	7704133.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al Cs H8 O6
Calculated formula	Al Cs O6
Title of publication	Inference of principal species in caustic aluminate solutions through solid-state spectroscopic characterization.
Authors of publication	Dembowski, Mateusz; Prange, Micah P.; Pouvreau, Maxime; Graham, Trent R.; Bowden, Mark E.; N'Diaye, Alpha; Schenter, Gregory K.; Clark, Sue B.; Clark, Aurora E.; Rosso, Kevin M.; Pearce, Carolyn I.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	18
Pages of publication	5869 - 5880
a	10.4124 ± 0.0015 Å
b	6.6986 ± 0.001 Å
c	6.2156 ± 0.001 Å
α	90°
β	126.129 ± 0.004°
γ	90°
Cell volume	350.16 ± 0.09 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0274
Residual factor for significantly intense reflections	0.0274
Weighted residual factors for significantly intense reflections	0.0786
Weighted residual factors for all reflections included in the refinement	0.0786
Goodness-of-fit parameter for all reflections included in the refinement	1.207
Diffraction radiation wavelength	0.56086 Å
Diffraction radiation type	AgKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
252802 (current)	2020-06-05	cif/ Updating files of 7704131, 7704132, 7704133 Original log message: Adding full bibliography for 7704131--7704133.cif.	7704133.cif
250966	2020-04-21	cif/ Adding structures of 7704131, 7704132, 7704133 via cif-deposit CGI script.	7704133.cif