Crystallography Open Database

Information card for entry 4500791

Preview

Coordinates	4500791.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C120 H92 Cl2 N18 O33 Yb4
Calculated formula	C120 H92 Cl2 N18 O33 Yb4
Title of publication	Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand
Authors of publication	Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	8
Pages of publication	3479
a	12.768 ± 0.003 Å
b	16.619 ± 0.003 Å
c	39.917 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	8470 ± 3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0879
Residual factor for significantly intense reflections	0.0787
Weighted residual factors for significantly intense reflections	0.2166
Weighted residual factors for all reflections included in the refinement	0.2285
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179538 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/07.	4500791.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500791.cif
34635	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500789, 4500790, 4500791, 4500792, 4500793, 4500794 via cif-deposit CGI script.	4500791.cif