Crystallography Open Database

Information card for entry 7049649

Preview

Coordinates	7049649.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H21 Dy N6 O8
Calculated formula	C31 H21 Dy N6 O8
Title of publication	Three Dy(iii) single-ion magnets bearing the tropolone ligand: structure, magnetic properties and theoretical elucidation.
Authors of publication	Chen, Zilu; Yu, Shui; Wang, Rongdong; Li, Bo; Yin, Bing; Liu, Dongcheng; Liang, Yuning; Yao, Di; Liang, Fupei
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	19
Pages of publication	6627 - 6637
a	12.674 ± 0.006 Å
b	17.476 ± 0.009 Å
c	12.846 ± 0.006 Å
α	90°
β	96.1 ± 0.04°
γ	90°
Cell volume	2829 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0413
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0599
Weighted residual factors for all reflections included in the refinement	0.0639
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
224170 (current)	2019-11-08	cif/ Updating files of 7049649, 7049650, 7049651 Original log message: Adding full bibliography for 7049649--7049651.cif.	7049649.cif
214595	2019-04-11	cif/ Adding structures of 7049649, 7049650, 7049651 via cif-deposit CGI script.	7049649.cif