Crystallography Open Database

Information card for entry 7062189

Preview

Coordinates	7062189.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H38 Er2 N2 O17
Calculated formula	C51 H38 Er2 N2 O17
Title of publication	Synthesis, structure analysis and catalytic activity of two Ln-coordination polymers containing benzophenone-4,4′-dicarboxylate linker
Authors of publication	Hajiashrafi, Taraneh; Sheikholeslami, Mohaddeseh; Arjanaki, Maryam Ahmadi; Tarighi, Sara; Guo, Zhifang; Junk, Peter C.
Journal of publication	New Journal of Chemistry
Year of publication	2023
Journal volume	47
Journal issue	5
Pages of publication	2230 - 2239
a	9.3025 ± 0.0013 Å
b	9.3025 ± 0.0013 Å
c	54.665 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	4730.5 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.0287
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.0727
Weighted residual factors for all reflections included in the refinement	0.0732
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
281507 (current)	2023-03-04	cif/ Updating files of 7062189, 7062190 Original log message: Adding full bibliography for 7062189--7062190.cif.	7062189.cif
280117	2023-01-05	cif/ Adding structures of 7062189, 7062190 via cif-deposit CGI script.	7062189.cif