Crystallography Open Database

Information card for entry 2227953

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Structure parameters

Chemical name	<i>catena</i>-Poly[[bis(μ-5-bromopyridine-3-carboxylato- κ^2^<i>O</i>:<i>O</i>')dicopper(II)]-bis(μ-5-bromopyridine-3-carboxylato)- κ^3^<i>O</i>,<i>O</i>':<i>N</i>;κ^3^<i>N</i>:<i>O</i>,<i>O</i>']
Formula	C24 H12 Br4 Cu2 N4 O8
Calculated formula	C24 H12 Br4 Cu2 N4 O8
Title of publication	<i>catena</i>-Poly[[bis(μ-5-bromopyridine-3-carboxylato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)]-bis(μ-5-bromopyridine-3-carboxylato)-κ^3^<i>O</i>,<i>O</i>':<i>N</i>;κ^3^<i>N</i>:<i>O</i>,<i>O</i>']
Authors of publication	DeBurgomaster, Paul; Zubieta, Jon
Journal of publication	Acta Crystallographica Section E
Year of publication	2010
Journal volume	66
Journal issue	11
Pages of publication	m1459
a	11.139 ± 0.0012 Å
b	11.5866 ± 0.0013 Å
c	12.6325 ± 0.0014 Å
α	90°
β	115.432 ± 0.002°
γ	90°
Cell volume	1472.4 ± 0.3 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 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	0.0252
Residual factor for significantly intense reflections	0.0212
Weighted residual factors for significantly intense reflections	0.052
Weighted residual factors for all reflections included in the refinement	0.0535
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181200 (current)	2016-04-03	hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/79.	2227953.cif 2227953.hkl
176789	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22.	2227953.cif 2227953.hkl
120072	2014-07-11	Adding DOIs to range 2 structures.	2227953.cif 2227953.hkl
88064	2013-08-29	Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet.	2227953.cif 2227953.hkl
26848	2011-09-28	cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree.	2227953.cif 2227953.hkl
5269	2010-12-22	hkl/ Adding Fobs data for the recent IUCr-published structres.	2227953.cif 2227953.hkl
4990	2010-12-18	../uploads/cif-deposit/cod/cif Adding structures of 2227953 via cif-deposit CGI script.	2227953.cif