Crystallography Open Database

Information card for entry 4349005

Preview

Coordinates	4349005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H36 Br2 F12 N4 O10 Y2
Calculated formula	C52 H30 Br2 F12 N4 O10 Y2
Title of publication	Modulating single-molecule magnet behaviour of phenoxo-O bridged lanthanide(iii) dinuclear complexes by using different β-diketonate coligands
Authors of publication	Wang, Wen-Min; Wang, Shi-Yu; Zhang, Hong-Xia; Shen, Hai-Yun; Zou, Ji-Yong; Gao, Hong-Ling; Cui, Jian-Zhong; Zhao, Bin
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2016
Journal volume	3
Journal issue	1
Pages of publication	133
a	16.759 ± 0.003 Å
b	16.602 ± 0.003 Å
c	19.907 ± 0.004 Å
α	90°
β	99.08 ± 0.03°
γ	90°
Cell volume	5469.4 ± 1.8 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	7
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	0.0907
Residual factor for significantly intense reflections	0.0599
Weighted residual factors for significantly intense reflections	0.1435
Weighted residual factors for all reflections included in the refinement	0.161
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
233538 (current)	2019-11-23	cif/ Adding structures of 4349005, 4349006, 4349007 via cif-deposit CGI script.	4349005.cif