Crystallography Open Database

Information card for entry 7110870

Preview

Coordinates	7110870.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H62 O13 Ru4 W2
Calculated formula	C40 H56 O13 Ru4 W2
Title of publication	(η6-Arene)ruthenium oxomolybdenum and oxotungsten clusters. Stereochemical non-rigidity of [{Ru(η6-p-MeC6H4Pri)}4Mo4O16] and crystal structure of [{Ru(η6-p-MeC6H4Pri)}4W2O10]
Authors of publication	Artero, Vincent; Proust, Anna; Herson, Patrick; Thouvenot, René; Gouzerh, Pierre
Journal of publication	Chemical Communications
Year of publication	2000
Journal issue	10
Pages of publication	883
a	13.857 ± 0.007 Å
b	13.898 ± 0.008 Å
c	14.232 ± 0.006 Å
α	114.01 ± 0.04°
β	91.01 ± 0.04°
γ	112.79 ± 0.04°
Cell volume	2258 ± 2 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.0654
Goodness-of-fit parameter for significantly intense reflections	1.1315
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
211332 (current)	2018-10-05	cif/ Fixing enumeration values for CIF data items _atom_sites_solution_* using cif_fix_values. Data item relocations and exclusion of CIF comment lines might have occurred due to the usage of cif_filter.	7110870.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7110870.cif
95983	2014-01-28	cif/ Adding structures of 7110870 via cif-deposit CGI script.	7110870.cif