Crystallography Open Database

Information card for entry 7057769

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Coordinates	7057769.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H85 Co O13 P3 S4 Tb
Calculated formula	C59 H85 Co O13 P3 S4 Tb
Title of publication	Thiacalix[4]arene-supported mononuclear lanthanide compounds: slow magnetic relaxation in dysprosium and erbium analogues
Authors of publication	Ge, Jing-Yuan; Chen, Zhongyan; Wang, Hai-Ying; Wang, Haiou; Wang, Peng; Duan, Xing; Huo, Dexuan
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	22
Pages of publication	17968
a	11.2885 ± 0.0003 Å
b	16.1038 ± 0.0004 Å
c	20.2585 ± 0.0006 Å
α	99.302 ± 0.001°
β	99.709 ± 0.001°
γ	102.88°
Cell volume	3461.76 ± 0.16 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0462
Residual factor for significantly intense reflections	0.0395
Weighted residual factors for significantly intense reflections	0.1227
Weighted residual factors for all reflections included in the refinement	0.1287
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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