Crystallography Open Database

Information card for entry 1567208

Preview

Coordinates	1567208.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H198 K2 N9 O20 Si10 U2
Calculated formula	C84 H198 K2 N9 O20 Si10 U2
Title of publication	Nitrogen activation and cleavage by a multimetallic uranium complex.
Authors of publication	Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella
Journal of publication	Chemical science
Year of publication	2022
Journal volume	13
Journal issue	27
Pages of publication	8025 - 8035
a	13.8976 ± 0.0004 Å
b	14.741 ± 0.0004 Å
c	18.5692 ± 0.0004 Å
α	106.635 ± 0.002°
β	103.811 ± 0.002°
γ	95.243 ± 0.002°
Cell volume	3487.04 ± 0.17 Å³
Cell temperature	139.99 ± 0.1 K
Ambient diffraction temperature	139.99 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0634
Residual factor for significantly intense reflections	0.0592
Weighted residual factors for significantly intense reflections	0.1574
Weighted residual factors for all reflections included in the refinement	0.1614
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
277096 (current)	2022-08-06	cif/ Updating files of 1567201, 1567202, 1567203, 1567204, 1567205, 1567206, 1567207, 1567208, 1567209, 1567210, 1567211, 1567212 Original log message: Adding full bibliography for 1567201--1567212.cif.	1567208.cif
276455	2022-07-01	cif/ Adding structures of 1567201, 1567202, 1567203, 1567204, 1567205, 1567206, 1567207, 1567208, 1567209, 1567210, 1567211, 1567212 via cif-deposit CGI script.	1567208.cif