Crystallography Open Database

Information card for entry 4308525

Preview

Coordinates	4308525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H116 Cl0.5 Cu16 Gd6 N57.5 O106.5
Calculated formula	C36 H116 Cl0.5 Cu16 Gd6 N57.5 O106.54
Title of publication	Controlled Aggregation of Heterometallic Nanoscale Cu12Ln6 Clusters (Ln = GdIII or NdIII) into 2D Coordination Polymers
Authors of publication	Feng He; Ming-Liang Tong; Xiao-Lan Yu; Xiao-Ming Chen
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	559 - 565
a	20.3962 ± 0.0004 Å
b	20.3962 ± 0.0004 Å
c	18.8438 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	7839.1 ± 0.4 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	7
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.046
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.1328
Weighted residual factors for all reflections included in the refinement	0.1382
Goodness-of-fit parameter for all reflections included in the refinement	1.138
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4308525.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308525.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308525.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4308525.cif