Crystallography Open Database

Information card for entry 1567201

Preview

Coordinates	1567201.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H144 Cs N3 O16 Si8 U2
Calculated formula	C60 H144 Cs N3 O16 Si8 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	14.1418 ± 0.0002 Å
b	16.3515 ± 0.0002 Å
c	22.1403 ± 0.0003 Å
α	107.364 ± 0.0013°
β	92.5382 ± 0.0012°
γ	108.194 ± 0.0014°
Cell volume	4588.44 ± 0.12 Å³
Cell temperature	140 ± 0.1 K
Ambient diffraction temperature	140 ± 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	0.0262
Residual factor for significantly intense reflections	0.0238
Weighted residual factors for significantly intense reflections	0.0509
Weighted residual factors for all reflections included in the refinement	0.0516
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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.	1567201.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.	1567201.cif