Crystallography Open Database

Information card for entry 1569013

Preview

Coordinates	1569013.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H84 Gd2 N4
Calculated formula	C68 H84 Gd2 N4
Title of publication	Magnetic hysteresis and large coercivity in bisbenzimidazole radical-bridged dilanthanide complexes.
Authors of publication	Benner, Florian; La Droitte, Léo; Cador, Olivier; Le Guennic, Boris; Demir, Selvan
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	21
Pages of publication	5577 - 5592
a	15.59 ± 0.0002 Å
b	13.659 ± 0.0001 Å
c	15.5654 ± 0.0002 Å
α	90°
β	116.337 ± 0.001°
γ	90°
Cell volume	2970.51 ± 0.06 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0246
Residual factor for significantly intense reflections	0.024
Weighted residual factors for significantly intense reflections	0.061
Weighted residual factors for all reflections included in the refinement	0.0613
Goodness-of-fit parameter for all reflections included in the refinement	1.103
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
284247 (current)	2023-06-05	cif/ Updating files of 1569012, 1569013, 1569014, 1569015, 1569016, 1569017 Original log message: Adding full bibliography for 1569012--1569017.cif.	1569013.cif
282963	2023-05-04	cif/ Adding structures of 1569012, 1569013, 1569014, 1569015, 1569016, 1569017 via cif-deposit CGI script.	1569013.cif