Crystallography Open Database

Information card for entry 1571931

1571930 << 1571931 >> 1571932

Preview

Coordinates	1571931.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45.75 H108 Mo10 N5 O36 U
Calculated formula	C42 H99 Mo10 N5 O36 U
Title of publication	Leveraging a reduced polyoxomolybdate-alkoxide cluster for the formation of a stable U(v) sandwich complex.
Authors of publication	Shiels, Dominic; Brennessel, William W.; Crawley, Matthew R.; Matson, Ellen M.
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	28
Pages of publication	11072 - 11083
a	21.7821 ± 0.0005 Å
b	15.0682 ± 0.0004 Å
c	24.1223 ± 0.0006 Å
α	90°
β	92.925 ± 0.002°
γ	90°
Cell volume	7907 ± 0.3 Å³
Cell temperature	100.2 ± 0.4 K
Ambient diffraction temperature	100.2 ± 0.4 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	0.0756
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.0972
Weighted residual factors for all reflections included in the refinement	0.1141
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.56087 Å
Diffraction radiation type	AgKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
293747 (current)	2024-08-05	cif/ Updating files of 1571928, 1571929, 1571930, 1571931, 1571932 Original log message: Adding full bibliography for 1571928--1571932.cif.	1571931.cif
292434	2024-06-18	cif/ Adding structures of 1571928, 1571929, 1571930, 1571931, 1571932 via cif-deposit CGI script.	1571931.cif