Crystallography Open Database

Information card for entry 1570266

Preview

Coordinates	1570266.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C97 H206 K2.7 N4 O31 Si6 U2
Calculated formula	C97 H206 K2.7 N4 O31 Si6 U2
Title of publication	Dinitrogen cleavage by a dinuclear uranium(iii) complex.
Authors of publication	Jori, Nadir; Keener, Megan; Rajeshkumar, Thayalan; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	46
Pages of publication	13485 - 13494
a	14.1801 ± 0.0002 Å
b	29.9313 ± 0.0006 Å
c	33.7708 ± 0.0006 Å
α	90°
β	93.6381 ± 0.0018°
γ	90°
Cell volume	14304.4 ± 0.4 Å³
Cell temperature	140 ± 0.1 K
Ambient diffraction temperature	140 ± 0.1 K
Number of distinct elements	7
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	0.1299
Residual factor for significantly intense reflections	0.0714
Weighted residual factors for significantly intense reflections	0.1696
Weighted residual factors for all reflections included in the refinement	0.2065
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
288738 (current)	2024-01-06	cif/ Updating files of 1570263, 1570264, 1570265, 1570266, 1570267 Original log message: Adding full bibliography for 1570263--1570267.cif.	1570266.cif
287444	2023-11-07	cif/ Adding structures of 1570263, 1570264, 1570265, 1570266, 1570267 via cif-deposit CGI script.	1570266.cif