Crystallography Open Database

Information card for entry 4314530

Preview

Coordinates	4314530.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C114 H112 B Co3 F4 N6 O4 P8
Calculated formula	C114 H112 B Co3 F4 N6 O4 P8
Title of publication	Cyanide Lability and Linkage Isomerism of Hexacyanochromate(III) Induced by the Co(II) Ion
Authors of publication	Carolina Avendano; Ferdi Karadas; Matthew Hilfiger; Michael Shatruk; Kim R. Dunbar
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	583 - 594
a	12.6532 ± 0.0009 Å
b	21.7176 ± 0.0015 Å
c	19.395 ± 0.0013 Å
α	90°
β	92.207 ± 0.001°
γ	90°
Cell volume	5325.7 ± 0.6 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	8
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	0.093
Residual factor for significantly intense reflections	0.0855
Weighted residual factors for significantly intense reflections	0.2026
Weighted residual factors for all reflections included in the refinement	0.2081
Goodness-of-fit parameter for all reflections included in the refinement	1.079
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4314530.html