Crystallography Open Database

Information card for entry 4314544

Preview

Coordinates	4314544.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H41 Cu3 N9 O16 Yb
Calculated formula	C51 H41 Cu3 N9 O16 Yb
Title of publication	Novel Three-Dimensional Pillared-Layer Ln(III)-Cu(I) Coordination Polymers Featuring Spindle-Shaped Heterometallic Building Units
Authors of publication	Qi-Bing Bo; Guo-Xin Sun; Dong-Ling Geng
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	561 - 571
a	23.586 ± 0.002 Å
b	10.4497 ± 0.001 Å
c	21.655 ± 0.002 Å
α	90°
β	105.252 ± 0.002°
γ	90°
Cell volume	5149.2 ± 0.8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0689
Weighted residual factors for all reflections included in the refinement	0.0754
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179221 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/45.	4314544.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4314544.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4314544.cif
7687	2011-02-02	../uploads/cif-deposit/cod/cif Adding structures of 4314544 via cif-deposit CGI script.	4314544.cif