Crystallography Open Database

Information card for entry 4331758

Preview

Coordinates	4331758.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H44 N9 O13 Ru3 S6
Calculated formula	C12 H36 N9 O13 Ru3 S6
Title of publication	Linear-Type S-Bridged Triruthenium Complexes with Aliphatic Aminothiolate Ligands: Synthesis, Characterization, and Properties
Authors of publication	Matsuura, Noriyuki; Igashira-Kamiyama, Asako; Kawamoto, Tatsuya; Konno, Takumi
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	1
Pages of publication	401 - 408
a	9.11 ± 0.018 Å
b	9.07 ± 0.02 Å
c	12.143 ± 0.018 Å
α	70.29 ± 0.15°
β	68.29 ± 0.14°
γ	77.8 ± 0.18°
Cell volume	873 ± 3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0312
Weighted residual factors for significantly intense reflections	0.0741
Weighted residual factors for all reflections included in the refinement	0.0792
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179420 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/17.	4331758.cif
97863	2014-01-29	cif/ Adding structures of 4331758, 4331759 via cif-deposit CGI script.	4331758.cif