Crystallography Open Database

Information card for entry 4112328

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Coordinates	4112328.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H47 O12 P Pt Ru5
Calculated formula	C40 H47 O12 P Pt Ru5
Title of publication	Platinum Participation in the Hydrogenation of Phenylacetylene by Ru~5~(CO)~15~(C)[Pt(PBut~3~)]
Authors of publication	Adams, Richard D.; Captain, Burjor; Zhu, Lei
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Journal issue	10
Pages of publication	3042 - 3043
a	12.3991 ± 0.0009 Å
b	12.6807 ± 0.001 Å
c	16.5292 ± 0.0012 Å
α	105.157 ± 0.002°
β	104.028 ± 0.002°
γ	94.753 ± 0.002°
Cell volume	2403.8 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0431
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0741
Weighted residual factors for all reflections included in the refinement	0.0786
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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