Crystallography Open Database

Information card for entry 7203325

7203324 << 7203325 >> 7203326

Preview

Coordinates	7203325.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H48 Cl4 Cu4 N20 O28.13
Calculated formula	C52 H48 Cl4 Cu4 N20 O28.134
Title of publication	Self-assembled polymetallic square grids ([2 ? 2] M4, [3 ? 3] M9) and trigonal bipyramidal clusters (M5)?structural and magnetic properties
Authors of publication	Dawe, Louise N.; Abedin, Tareque S. M.; Kelly, Timothy L.; Thompson, Laurence K.; Miller, David O.; Zhao, Liang; Wilson, Claire; Leech, Michael A.; Howard, Judith A. K.
Journal of publication	Journal of Materials Chemistry
Year of publication	2006
Journal volume	16
Journal issue	26
Pages of publication	2645
a	19.9608 ± 0.001 Å
b	17.0907 ± 0.0009 Å
c	21.2188 ± 0.0011 Å
α	90°
β	96.983 ± 0.001°
γ	90°
Cell volume	7185 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0434
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.1024
Weighted residual factors for all reflections included in the refinement	0.1081
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
180364 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/33.	7203325.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7203325.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7203325.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7203325.cif