Crystallography Open Database

Information card for entry 4060816

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Coordinates	4060816.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H50 Ir3 S4
Calculated formula	C33 Ir3 S4
Title of publication	Synthesis of a New Tetrakis(hydrosulfido) Diiridium Complex and Its Conversion into Homo- and Heterometallic Sulfido-Hydrosulfido Clusters
Authors of publication	Takagi, Fusao; Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu
Journal of publication	Organometallics
Year of publication	2002
Journal volume	21
Journal issue	4
Pages of publication	694 - 699
a	17.522 ± 0.002 Å
b	19.011 ± 0.002 Å
c	12.912 ± 0.001 Å
α	90°
β	122.465 ± 0.007°
γ	90°
Cell volume	3628.8 ± 0.7 Å³
Cell temperature	296.2 K
Ambient diffraction temperature	296.2 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0478
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.0588
Weighted residual factors for all reflections included in the refinement	0.0588
Goodness-of-fit parameter for all reflections included in the refinement	1.944
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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