Crystallography Open Database

Information card for entry 7063466

Preview

Coordinates	7063466.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H54 Ce N4 O Si4
Calculated formula	C33 H54 Ce N4 O Si4
Title of publication	Advancing the understanding of M–O covalency in isostructural M–OSiMe3 (M = Ce, Th, U) complexes
Authors of publication	Liu, Kang; Chi, Xiaowang; Guo, Yan; Hu, Kongqiu; Mei, Lei; Yu, Jipan; Shi, Weiqun
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	42
Pages of publication	18241 - 18248
a	16.9979 ± 0.0006 Å
b	16.9979 ± 0.0006 Å
c	23.6994 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	5930.1 ± 0.4 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150.15 K
Number of distinct elements	6
Space group number	161
Hermann-Mauguin space group symbol	R 3 c :H
Hall space group symbol	R 3 -2"c
Residual factor for all reflections	0.0368
Residual factor for significantly intense reflections	0.0327
Weighted residual factors for significantly intense reflections	0.083
Weighted residual factors for all reflections included in the refinement	0.0874
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
296636 (current)	2024-12-06	cif/ Updating files of 7063465, 7063466, 7063467, 7063468, 7063469 Original log message: Adding full bibliography for 7063465--7063469.cif.	7063466.cif
295030	2024-10-04	cif/ Adding structures of 7063465, 7063466, 7063467, 7063468, 7063469 via cif-deposit CGI script.	7063466.cif