Crystallography Open Database

Information card for entry 4120023

4120022 << 4120023 >> 4120024

Preview

Coordinates	4120023.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H115 K2 O13.5 Si4 Tb
Calculated formula	C62 H115 K2 O13.5 Si4 Tb
Title of publication	Completing the Series of +2 Ions for the Lanthanide Elements: Synthesis of Molecular Complexes of Pr2+, Gd2+, Tb2+, and Lu2+
Authors of publication	Matthew R. MacDonald; Jefferson E. Bates; Joseph W. Ziller; Filipp Furche; William J. Evans
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	9857 - 9868
a	25.7503 ± 0.0014 Å
b	11.6143 ± 0.0006 Å
c	26.3215 ± 0.0014 Å
α	90°
β	104.005 ± 0.0006°
γ	90°
Cell volume	7638 ± 0.7 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	6
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	0.0299
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0669
Weighted residual factors for all reflections included in the refinement	0.0695
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4120023.html