Crystallography Open Database

Information card for entry 7127891

Preview

Coordinates	7127891.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H72 Na4 O57 Ru4 S12 W12
Calculated formula	C24 H72 Na4 O57 Ru4 S12 W12
Title of publication	Discovery of two Na<sup>+</sup>-centered Silverton-type polyoxometalates {NaM<sub>12</sub>O<sub>42</sub>} (M = Mo, W).
Authors of publication	Wan, Rong; Liu, Zhen; Ma, Xinyi; Li, Huafeng; Ma, Pengtao; Zhang, Chao; Niu, Jingyang; Wang, Jingping
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	17
Pages of publication	2172 - 2175
a	17.9539 ± 0.0009 Å
b	17.9539 ± 0.0009 Å
c	17.9539 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	5787.3 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	218
Hermann-Mauguin space group symbol	P -4 3 n
Hall space group symbol	P -4n 2 3
Residual factor for all reflections	0.0397
Residual factor for significantly intense reflections	0.0277
Weighted residual factors for significantly intense reflections	0.072
Weighted residual factors for all reflections included in the refinement	0.0779
Goodness-of-fit parameter for all reflections included in the refinement	1.124
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
262474 (current)	2021-03-05	cif/ Updating files of 7127890, 7127891 Original log message: Adding full bibliography for 7127890--7127891.cif.	7127891.cif
261362	2021-02-02	cif/ Adding structures of 7127890, 7127891 via cif-deposit CGI script.	7127891.cif