Crystallography Open Database

Information card for entry 7125657

Preview

Coordinates	7125657.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	K10 Mo18 O94 P2 Ti2
Calculated formula	K10 Mo18 O94 P2 Ti2
Title of publication	Water-soluble titanium-polyoxomolybdate with external μ<sub>3</sub> bridging oxygen coordination on a lacunary Keggin structure.
Authors of publication	Xu, Ming; Wang, Ting; Li, Fengyan; Xu, Wenjuan; Zheng, Yue; Xu, Lin
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	7
Pages of publication	1097 - 1100
a	12.375 ± 0.0004 Å
b	13.5901 ± 0.0005 Å
c	16.7251 ± 0.0007 Å
α	103.174 ± 0.003°
β	110.846 ± 0.003°
γ	94.834 ± 0.003°
Cell volume	2516.86 ± 0.18 Å³
Cell temperature	298.15 K
Ambient diffraction temperature	298.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0871
Residual factor for significantly intense reflections	0.0659
Weighted residual factors for significantly intense reflections	0.2011
Weighted residual factors for all reflections included in the refinement	0.226
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
247609 (current)	2020-02-04	cif/ Updating files of 7125657, 7125710 Original log message: Adding full bibliography for 7125657--7125710.cif.	7125657.cif
245226	2019-12-17	cif/ Adding structures of 7125657 via cif-deposit CGI script.	7125657.cif