Crystallography Open Database

Information card for entry 4307309

Preview

Coordinates	4307309.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C115.25 H96 Co5 N24 O11
Calculated formula	C115.25 H96 Co5 N24 O8.75
Title of publication	Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals
Authors of publication	Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	5155 - 5165
a	19.494 ± 0.002 Å
b	25.075 ± 0.003 Å
c	24.727 ± 0.003 Å
α	90°
β	98.979 ± 0.002°
γ	90°
Cell volume	11939 ± 2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1536
Residual factor for significantly intense reflections	0.0776
Weighted residual factors for significantly intense reflections	0.2183
Weighted residual factors for all reflections included in the refinement	0.2676
Goodness-of-fit parameter for all reflections included in the refinement	1.004
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179111 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/73.	4307309.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307309.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307309.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307309.cif