Crystallography Open Database

Information card for entry 1574046

Preview

Coordinates	1574046.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H37 Dy N3 O9.5
Calculated formula	C36 H37 Dy N3 O9.5
Title of publication	Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework.
Authors of publication	Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	6
Pages of publication	2879 - 2885
a	8.0212 ± 0.0005 Å
b	26.89 ± 0.002 Å
c	16.3817 ± 0.0018 Å
α	90°
β	92.297 ± 0.008°
γ	90°
Cell volume	3530.5 ± 0.5 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120 ± 0.1 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0735
Residual factor for significantly intense reflections	0.0505
Weighted residual factors for significantly intense reflections	0.0734
Weighted residual factors for all reflections included in the refinement	0.0785
Goodness-of-fit parameter for all reflections included in the refinement	0.79
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
297953 (current)	2025-03-04	cif/ Adding structures of 1574044, 1574045, 1574046, 1574047, 1574048, 1574049, 1574050, 1574051, 1574052 via cif-deposit CGI script.	1574046.cif