Crystallography Open Database

Information card for entry 4324143

Preview

Coordinates	4324143.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H8 Cu2 Fe N6 O12
Calculated formula	C8 H8 Cu2 Fe N6 O12
Title of publication	Flexible Mixed-Spin Kagomé Coordination Polymers with Reversible Magnetism Triggered by Dehydration and Rehydration
Authors of publication	Wei-Xiong Zhang; Wei Xue; Xiao-Ming Chen
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	309 - 316
a	7.3363 ± 0.0014 Å
b	12.02 ± 0.002 Å
c	8.6697 ± 0.0016 Å
α	90°
β	104.213 ± 0.003°
γ	90°
Cell volume	741.1 ± 0.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0293
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0687
Weighted residual factors for all reflections included in the refinement	0.0715
Goodness-of-fit parameter for all reflections included in the refinement	1.117
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
179344 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/41.	4324143.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324143.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4324143.cif
24434	2011-08-23	../uploads/cif-deposit/cod/cif Adding structures of 4324143 via cif-deposit CGI script.	4324143.cif