Crystallography Open Database

Information card for entry 4064035

Preview

Coordinates	4064035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H34 Bi Cl5 Ru2 S
Calculated formula	C22 H17 Bi Cl5 Ru2 S
Title of publication	Preparation of Incomplete Cubane-Type Ru2M(μ3-S)(μ2-Cl)3Clusters (M = Sb, Bi) and Isolation of the Ru2Sb Cluster Having a Novel μ3-SO Ligand. Functions in Oxygen Atom Transfer and Catalytic Oxidation of PPh3to O═PPh3by Molecular O2
Authors of publication	Oya, Kazumasa; Seino, Hidetake; Akiizumi, Midori; Mizobe, Yasushi
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	11
Pages of publication	2939
a	10.3744 ± 0.0016 Å
b	23.785 ± 0.004 Å
c	11.8475 ± 0.0019 Å
α	90°
β	98.0292 ± 0.0005°
γ	90°
Cell volume	2894.8 ± 0.8 Å³
Cell temperature	293.1 K
Ambient diffraction temperature	293.1 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 significantly intense reflections	0.0331
Weighted residual factors for all reflections included in the refinement	0.1148
Goodness-of-fit parameter for all reflections included in the refinement	1.013
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4064035.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4064035.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4064035.cif
32763	2012-02-10	../uploads/cif-deposit/cod/cif Adding structures of 4064035, 4064036, 4064037, 4064038, 4064039 via cif-deposit CGI script.	4064035.cif