Crystallography Open Database

Information card for entry 7063469

Preview

Coordinates	7063469.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H45 Ce Cl N4 Si3
Calculated formula	C30 H45 Ce Cl N4 Si3
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	11.3841 ± 0.0004 Å
b	16.7664 ± 0.0007 Å
c	19.1613 ± 0.0007 Å
α	90°
β	106.492 ± 0.001°
γ	90°
Cell volume	3506.9 ± 0.2 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	6
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	0.0164
Residual factor for significantly intense reflections	0.0155
Weighted residual factors for significantly intense reflections	0.0386
Weighted residual factors for all reflections included in the refinement	0.0393
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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.	7063469.cif
295030	2024-10-04	cif/ Adding structures of 7063465, 7063466, 7063467, 7063468, 7063469 via cif-deposit CGI script.	7063469.cif