Crystallography Open Database

Information card for entry 7002749

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Coordinates	7002749.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	poly-(pentakis(mu-cyanido)-(diethylenetriamine-k3N,N',N'') dicopper(I/II)-nickel(II)
Formula	C9 H13 Cu2 N8 Ni
Calculated formula	C9 H13 Cu2 N8 Ni
Title of publication	Condensed heterometallic bidimensional mixed valence CuI/CuII/NiII cyanidometallate
Authors of publication	Beobide, Garikoitz; Castillo, Oscar; Cepeda, Javier; Luque, Antonio; Pérez-Yáñez, Sonia; Román, Pascual
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	44
Pages of publication	9722 - 9724
a	12.8823 ± 0.0003 Å
b	8.682 ± 0.0002 Å
c	13.3457 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1492.64 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0379
Residual factor for significantly intense reflections	0.0267
Weighted residual factors for significantly intense reflections	0.0621
Weighted residual factors for all reflections included in the refinement	0.0636
Goodness-of-fit parameter for all reflections included in the refinement	0.943
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
179731 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/27.	7002749.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002749.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002749.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002749.cif