Crystallography Open Database

Information card for entry 7011852

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Coordinates	7011852.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14.5 H11 Co N8 O
Calculated formula	C14.5 H8 Co N8 O
Title of publication	Syntheses, crystal structures, and magnetic properties of first row transition metal coordination polymers containing dicyanamide and 4,4???-bipyridineElectronic supplementary information (ESI) available: atom numbering diagrams for compounds 1 (123 K and 294 K) and 7???11. See http://www.rsc.org/suppdata/dt/b2/b205007b/
Authors of publication	Jensen, Paul; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	19
Pages of publication	3712
a	11.675 ± 0.0004 Å
b	19.4612 ± 0.0005 Å
c	7.3249 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1664.29 ± 0.1 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0685
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.1089
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7011852.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7011852.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7011852.cif
5312	2011-01-03	cif/ Adding files, updated with the 'cif_fix_enum' program and the cif_core.dic dictionary. The enumerator values were fixed, mostly incorrect case, but also some values that had extra underscores, dashes or spaces. Unfortunately, 22 had non-ASCII characters with the 8-th bit set, and these got incorrectly interpreted as latin1 characters and converted to their UTF8 equivalents by Perl. To fix the structures, however, they need to be redeposited from the original files with the new CIFParser/cif_filter version.	7011852.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7011852.cif