Crystallography Open Database

Information card for entry 7059061

Preview

Coordinates	7059061.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C160 H180 Gd4 N16 O16
Calculated formula	C156 H174 Gd4 N14 O16
Title of publication	Single molecule magnet behavior and magnetic refrigeration of four tetranuclear lanthanide (Ln = GdIII, TbIII, DyIII) clusters
Authors of publication	Yu, Hong; Cao, Jia-Miao; Zhang, Jun-Rui; Li, Rui-Cong; Cheng, Yan; Yang, Chen; Hou, Yin-Ling; Fang, Ming
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	48
Pages of publication	19429 - 19436
a	16.7993 ± 0.0005 Å
b	21.8519 ± 0.0007 Å
c	21.1006 ± 0.0007 Å
α	90°
β	96.051 ± 0.001°
γ	90°
Cell volume	7702.8 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0446
Residual factor for significantly intense reflections	0.0337
Weighted residual factors for significantly intense reflections	0.0787
Weighted residual factors for all reflections included in the refinement	0.089
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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
301442 (current)	2025-08-04	Updating journal pages, volumes and years from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	7059061.cif
231070	2019-11-20	cif/ Adding structures of 7059061, 7059062, 7059063, 7059064 via cif-deposit CGI script.	7059061.cif