Crystallography Open Database

Information card for entry 1572943

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Coordinates	1572943.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C75 H58 Cl Dy2 N9 O15
Calculated formula	C75 H58 Cl Dy2 N9 O15
Title of publication	Asymmetric [Dy2] molecules deposited into micro-SQUID susceptometers: in-situ characterization of their magnetic integrity
Authors of publication	Repollés, Ana; Pallarés, María Carmen; Aguilà, David; Roubeau, Olivier; Velasco, Veronica; Gella, Diego; BARRIOS MORENO, LEONI ALEJANDRA ALEJANDRA; Martinez Perez, Maria Jose; Sese, Javier; Drung, Dietmar; Martínez, Jesús Ignacio; Schurig, Thomas; Le Guennic, Boris; Lostao, Anabel; Aromi, Guillem; Luis, Fernando
Journal of publication	Nanoscale
Year of publication	2024
a	12.7916 ± 0.0004 Å
b	16.6444 ± 0.0004 Å
c	32.545 ± 0.001 Å
α	90°
β	97.104 ± 0.003°
γ	90°
Cell volume	6875.9 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1056
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.0976
Weighted residual factors for all reflections included in the refinement	0.1126
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
295617 (current)	2024-10-25	cif/ Adding structures of 1572943, 1572944 via cif-deposit CGI script.	1572943.cif