Crystallography Open Database

Information card for entry 7009638

Preview

Coordinates	7009638.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H6 Fe2 O17 Ru3 W
Calculated formula	C26 H6 Fe2.082 O17 Ru2.918 W
Title of publication	Syntheses and reactions of some cluster complexes containing C4 ligands with iron, ruthenium and cobalt carbonyls
Authors of publication	Bruce, Michael I.; Low, Paul J.; Zaitseva, Natasha N.; Kahlal, Samia; Halet, Jean-François; Skelton, Brian W.; White, Allan H.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2000
Journal issue	17
Pages of publication	2939
a	8.464 ± 0.001 Å
b	23.85 ± 0.003 Å
c	16.454 ± 0.002 Å
α	90°
β	90.798 ± 0.002°
γ	90°
Cell volume	3321.2 ± 0.7 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 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	0.057
Residual factor for significantly intense reflections	0.036
Weighted residual factors for all reflections	0.043
Weighted residual factors for all reflections included in the refinement	0.04
Goodness-of-fit parameter for all reflections	1.153
Goodness-of-fit parameter for all reflections included in the refinement	1.249
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7009638.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7009638.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7009638.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7009638.cif