Crystallography Open Database

Information card for entry 4323580

Preview

Coordinates	4323580.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H80 Cl6 Na2 O25 P8 Ru4 S4
Calculated formula	C24 Cl6 Na2 O24 P8 Ru4 S4
SMILES	[Ru]12(Cl)([S]3[Ru](Cl)([Cl]2)([S]13)([P](OC)(OC)OC)[P](OC)(OC)OC)([P](OC)(OC)OC)[P](OC)(OC)OC.[Na+]
Title of publication	Synthesis of a μ,η2-Disulfide-Bridged Hexanuclear RuII-Na Cluster Formed from the Reductive Coupling of a μ,η1-Disulfide-Bridged Dinuclear RuIII Complex
Authors of publication	Kazuko Matsumoto; Yoichi Sano
Journal of publication	Inorganic Chemistry
Year of publication	1997
Journal volume	36
Pages of publication	4405 - 4407
a	14.927 ± 0.003 Å
b	21.063 ± 0.007 Å
c	11.802 ± 0.004 Å
α	93.81 ± 0.03°
β	94.73 ± 0.02°
γ	69.24 ± 0.02°
Cell volume	3455.1 ± 1.8 Å³
Cell temperature	21 K
Ambient diffraction temperature	21 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.062
Weighted residual factors for significantly intense reflections	0.076
Goodness-of-fit parameter for significantly intense reflections	2.01
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
289268 (current)	2024-02-02	Fixing some Z values and formulae	4323580.cif
176467	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4323580.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4323580.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4323580.cif
23828	2011-08-11	../uploads/cif-deposit/cod/cif Adding structures of 4323580 via cif-deposit CGI script.	4323580.cif