Crystallography Open Database

Information card for entry 1570581

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Coordinates	1570581.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C118 H208 K2 Pr2 Si8
Calculated formula	C118 H208 K2 Pr2 Si8
Title of publication	It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers.
Authors of publication	Hauser, Adrian; Münzfeld, Luca; Uhlmann, Cedric; Lebedkin, Sergei; Schlittenhardt, Sören; Ruan, Ting-Ting; Kappes, Manfred M.; Ruben, Mario; Roesky, Peter W.
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	4
Pages of publication	1338 - 1347
a	13.8875 ± 0.0003 Å
b	33.4663 ± 0.0009 Å
c	26.021 ± 0.0006 Å
α	90°
β	92.638 ± 0.002°
γ	90°
Cell volume	12080.8 ± 0.5 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
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	0.1331
Residual factor for significantly intense reflections	0.0695
Weighted residual factors for significantly intense reflections	0.1323
Weighted residual factors for all reflections included in the refinement	0.1549
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation probe	x-ray
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
289405 (current)	2024-02-04	cif/ Updating files of 1570572, 1570573, 1570574, 1570575, 1570576, 1570577, 1570578, 1570579, 1570580, 1570581 Original log message: Adding full bibliography for 1570572--1570581.cif.	1570581.cif
288451	2023-12-21	cif/ Adding structures of 1570572, 1570573, 1570574, 1570575, 1570576, 1570577, 1570578, 1570579, 1570580, 1570581 via cif-deposit CGI script.	1570581.cif