Crystallography Open Database

Information card for entry 7134701

Preview

Coordinates	7134701.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H40 O18 Th3
Calculated formula	C70 H42 O18 Th3
Title of publication	From separation to photothermal conversion: selective crystallization of thorium from lanthanides.
Authors of publication	Yang, Junpu; Bai, Yaoyao; Zhang, Guangtao; Ma, Jingqi; Lin, Jian
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	58
Pages of publication	10776 - 10779
a	10.1687 ± 0.0004 Å
b	11.9584 ± 0.0005 Å
c	25.02 ± 0.0009 Å
α	91.179 ± 0.001°
β	95.315 ± 0.002°
γ	90.783 ± 0.002°
Cell volume	3028.4 ± 0.2 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0251
Residual factor for significantly intense reflections	0.0223
Weighted residual factors for significantly intense reflections	0.0561
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
301481 (current)	2025-08-05	cif/ Updating files of 7134701 Original log message: Adding full bibliography for 7134701.cif.	7134701.cif
300035	2025-06-11	cif/ Adding structures of 7134701 via cif-deposit CGI script.	7134701.cif