Crystallography Open Database

Information card for entry 7060462

Preview

Coordinates	7060462.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H46 N7 O19 Sm2
Calculated formula	C48 H46 N7 O19 Sm2
Title of publication	Lanthanide-based bis-(3,5-dicarboxy-phenyl)terephthalamide metal‒organic frameworks: slow relaxation of magnetization and detection of trace Fe2+ and Fe3+
Authors of publication	Lin, Qingfang; Xie, Wen; Zong, Zhihui; Liu, Zicheng; Sun, Yuqing; Liang, Lili
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	16
Pages of publication	7382 - 7389
a	36.6398 ± 0.0014 Å
b	21.2459 ± 0.0009 Å
c	19.1182 ± 0.0009 Å
α	90°
β	90.864 ± 0.002°
γ	90°
Cell volume	14880.8 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1139
Residual factor for significantly intense reflections	0.0703
Weighted residual factors for significantly intense reflections	0.1806
Weighted residual factors for all reflections included in the refinement	0.2191
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71076 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
264916 (current)	2021-05-05	cif/ Updating files of 7060461, 7060462 Original log message: Adding full bibliography for 7060461--7060462.cif.	7060462.cif
263153	2021-03-19	cif/ Adding structures of 7060461, 7060462 via cif-deposit CGI script.	7060462.cif