Crystallography Open Database

Information card for entry 4079326

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Coordinates	4079326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H42 Au2 Ir4 O9 P3
Calculated formula	C60 H42 Au2 Ir4 O9 P3
Title of publication	Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands
Authors of publication	Adams, Richard D.; Chen, Mingwei
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	17
Pages of publication	6457
a	13.7892 ± 0.0014 Å
b	13.9054 ± 0.0014 Å
c	17.8443 ± 0.0018 Å
α	85.321 ± 0.002°
β	75.087 ± 0.002°
γ	65.024 ± 0.002°
Cell volume	2995.7 ± 0.5 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 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	0.0831
Residual factor for significantly intense reflections	0.058
Weighted residual factors for significantly intense reflections	0.128
Weighted residual factors for all reflections included in the refinement	0.1398
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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