Crystallography Open Database

Information card for entry 7057768

Preview

Coordinates	7057768.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H85 Co Er O13 P3 S4
Calculated formula	C59 H85 Co Er O13 P3 S4
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	11.2008 ± 0.001 Å
b	15.916 ± 0.0014 Å
c	19.996 ± 0.0018 Å
α	99.6731 ± 0.0012°
β	100.026 ± 0.0013°
γ	102.89 ± 0.0013°
Cell volume	3341.4 ± 0.5 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 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	0.045
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1078
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7057768.html