Crystallography Open Database

Information card for entry 7245482

Preview

Coordinates	7245482.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H45 Er F18 O5.02 P2
Calculated formula	C63 H45 Er F18 O5.0233 P2
Title of publication	Effect on the geometry over the slow relaxation of the magnetization in a series of Erbium(III) complexes based on halogenated ligands.
Authors of publication	Long, Jérôme; Lyubov, Dmitry; Kissel, Alexander; Gogolev, Ilia A.; Tyutyunov, Andrey A.; Nelyubina, Yulia V.; Salles, Fabrice; Guari, Yannick; Cherkasov, Anton; Larionova, Joulia; Trifonov, Alexander
Journal of publication	CrystEngComm
Year of publication	2022
a	18.885 ± 0.012 Å
b	18.885 ± 0.012 Å
c	28.24 ± 0.02 Å
α	90°
β	90°
γ	120°
Cell volume	8722 ± 10 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.2037
Residual factor for significantly intense reflections	0.108
Weighted residual factors for significantly intense reflections	0.2474
Weighted residual factors for all reflections included in the refinement	0.3017
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
277848 (current)	2022-09-15	cif/ Adding structures of 7245481, 7245482, 7245483, 7245484, 7245485 via cif-deposit CGI script.	7245482.cif