Crystallography Open Database

Information card for entry 1571317

Preview

Coordinates	1571317.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H139 Fe2 N6 P8 Si4 Sm
Calculated formula	C55 H139 Fe2 N6 P8 Si4 Sm
Title of publication	Iron promoted end-on dinitrogen-bridging in heterobimetallic complexes of uranium and lanthanides.
Authors of publication	Jori, Nadir; Moreno, Juan J.; Shivaraam, R. A. Keerthi; Rajeshkumar, Thayalan; Scopelliti, Rosario; Maron, Laurent; Campos, Jesús; Mazzanti, Marinella
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	18
Pages of publication	6842 - 6852
a	11.4532 ± 0.0005 Å
b	29.5233 ± 0.0009 Å
c	23.5755 ± 0.0008 Å
α	90°
β	97.369 ± 0.004°
γ	90°
Cell volume	7905.9 ± 0.5 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	0.1143
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.103
Weighted residual factors for all reflections included in the refinement	0.1237
Goodness-of-fit parameter for all reflections included in the refinement	0.976
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
292915 (current)	2024-07-05	cif/ Updating files of 1571317, 1571318, 1571319, 1571320, 1571321, 1571322, 1571323, 1571324, 1571325 Original log message: Adding full bibliography for 1571317--1571325.cif.	1571317.cif
290732	2024-04-03	cif/ Adding structures of 1571317, 1571318, 1571319, 1571320, 1571321, 1571322, 1571323, 1571324, 1571325 via cif-deposit CGI script.	1571317.cif