Crystallography Open Database

Information card for entry 7203331

7203330 << 7203331 >> 7203332

Preview

Coordinates	7203331.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H134 Mn9 N72 O58
Calculated formula	C102 H78 Mn9 N72 O58
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	27.9255 ± 0.0013 Å
b	27.9255 ± 0.0013 Å
c	40.217 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	31363 ± 3 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.1356
Residual factor for significantly intense reflections	0.1278
Weighted residual factors for significantly intense reflections	0.3008
Weighted residual factors for all reflections included in the refinement	0.3049
Goodness-of-fit parameter for all reflections included in the refinement	1.348
Diffraction radiation wavelength	0.7107 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.	7203331.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7203331.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7203331.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7203331.cif