Crystallography Open Database

Information card for entry 7059319

Preview

Coordinates	7059319.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B19 Ba24 O57 Rb9
Calculated formula	B19 Ba24 O57 Rb9
Title of publication	Synthesis, characterization and crystal structure of a new mixed alkali and alkaline-earth metal borate Rb9Ba24(BO3)19
Authors of publication	Niu, Xiaowen; Wang, Li
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	10
Pages of publication	3882 - 3887
a	16.977 ± 0.003 Å
b	16.977 ± 0.003 Å
c	7.282 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	1817.6 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	164
Hermann-Mauguin space group symbol	P -3 m 1
Hall space group symbol	-P 3 2"
Residual factor for all reflections	0.0355
Residual factor for significantly intense reflections	0.027
Weighted residual factors for significantly intense reflections	0.0605
Weighted residual factors for all reflections included in the refinement	0.0633
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
257657 (current)	2020-10-06	cif/ Updating files of 7059319 Original log message: Adding full bibliography for 7059319.cif.	7059319.cif
250339	2020-04-05	cif/ Updating files of 7059319 Original log message: Adding full bibliography for 7059319.cif.	7059319.cif
248146	2020-02-14	cif/ Adding structures of 7059319 via cif-deposit CGI script.	7059319.cif