Crystallography Open Database

Information card for entry 7707867

Preview

Coordinates	7707867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F Ga I3 Na O9
Calculated formula	F Ga I3 Na O9
Title of publication	NaGaI<sub>3</sub>O<sub>9</sub>F: a new alkali metal gallium iodate combined with IO<sub>3</sub><sup>-</sup> and IO<sub>3</sub>F<sup>2-</sup> units.
Authors of publication	Wang, Dandan; Gong, Pifu; Zhang, Xinyuan; Lin, Zheshuai; Hu, Zhanggui; Wu, Yicheng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	33
Pages of publication	11562 - 11567
a	14.12 ± 0.0019 Å
b	4.9149 ± 0.0006 Å
c	13.6307 ± 0.0019 Å
α	90°
β	112.968 ± 0.004°
γ	90°
Cell volume	871 ± 0.2 Å³
Cell temperature	299 ± 2 K
Ambient diffraction temperature	299 K
Number of distinct elements	5
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	0.0731
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0618
Weighted residual factors for all reflections included in the refinement	0.0727
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
268748 (current)	2021-09-06	cif/ Updating files of 7707867 Original log message: Adding full bibliography for 7707867.cif.	7707867.cif
267689	2021-07-22	cif/ Adding structures of 7707867 via cif-deposit CGI script.	7707867.cif