Crystallography Open Database

Information card for entry 7230408

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Coordinates	7230408.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H86 Er4 N6 O28
Calculated formula	C76 H86 Er4 N6 O28
Title of publication	A series of Ln4III clusters: Dy4 single molecule magnet and Tb4 multi-responsive luminescent sensor for Fe3+, CrO42−/Cr2O72− and 4-nitroaniline
Authors of publication	Qin, Yaru; Ge, Yu; Zhang, Shasha; Sun, Hao; Jing, Yu; Li, Yahong; Liu, Wei
Journal of publication	RSC Advances
Year of publication	2018
Journal volume	8
Journal issue	23
Pages of publication	12641
a	13.4131 ± 0.0007 Å
b	11.8637 ± 0.0007 Å
c	24.458 ± 0.0014 Å
α	90°
β	96.222 ± 0.002°
γ	90°
Cell volume	3869.1 ± 0.4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	119.99 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	0.0413
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0546
Weighted residual factors for all reflections included in the refinement	0.0563
Goodness-of-fit parameter for all reflections included in the refinement	1.206
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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