Crystallography Open Database

Information card for entry 7250133

Preview

Coordinates	7250133.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H15.5 Br5 La N2 O11.75
Calculated formula	C27 H12 Br5 La N2 O10
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	12.011 ± 0.002 Å
b	26.422 ± 0.005 Å
c	10.489 ± 0.002 Å
α	90°
β	108.86 ± 0.03°
γ	90°
Cell volume	3150 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0746
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.1583
Weighted residual factors for all reflections included in the refinement	0.171
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.710917 Å
Diffraction radiation type	Synchrotron
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.	7250133.cif
298544	2025-03-21	cif/ Adding structures of 7250132, 7250133, 7250134, 7250135, 7250136, 7250137, 7250138, 7250139, 7250140 via cif-deposit CGI script.	7250133.cif