Crystallography Open Database

Information card for entry 7250138

Preview

Coordinates	7250138.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H50 Cl8 La2 N6 O29
Calculated formula	C46 H50 Cl8 La2 N6 O29
Title of publication	The effect of viologen counterions on the topologies of La(iii)–tetraoxolene metal–organic frameworks
Authors of publication	Feng, Yuying; Hua, Carol; van Koeverden, Martin P.
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	16
Pages of publication	2559 - 2569
a	13.0706 ± 0.0002 Å
b	13.8311 ± 0.0002 Å
c	18.0949 ± 0.0002 Å
α	92.541 ± 0.001°
β	90.289 ± 0.001°
γ	101.008 ± 0.001°
Cell volume	3207.56 ± 0.08 Å³
Cell temperature	99.98 ± 0.1 K
Ambient diffraction temperature	99.98 ± 0.1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0481
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.1276
Weighted residual factors for all reflections included in the refinement	0.1294
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
300709 (current)	2025-07-06	cif/ Updating files of 7250132, 7250133, 7250134, 7250135, 7250136, 7250137, 7250138, 7250139, 7250140 Original log message: Adding full bibliography for 7250132--7250140.cif.	7250138.cif
298544	2025-03-21	cif/ Adding structures of 7250132, 7250133, 7250134, 7250135, 7250136, 7250137, 7250138, 7250139, 7250140 via cif-deposit CGI script.	7250138.cif