Crystallography Open Database

Information card for entry 7116897

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Coordinates	7116897.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C212.07 H84 Cl4 O66.07 Ru11.36
Calculated formula	C212.074 H84 Cl4 O66.074 Ru11.358
Title of publication	Synthesis and characterization of bis-triruthenium cluster derivatives of an all equatorial [60]fullerene tetramalonate
Authors of publication	Chia-Hsiang Chen; Amineh Aghabali; Catalina Suarez; Marilyn M. Olmstead; Alan L. Balch; Luis Echegoyen
Journal of publication	Chem.Commun.
Year of publication	2015
Journal volume	51
Pages of publication	6489
a	16.3234 ± 0.001 Å
b	16.3914 ± 0.001 Å
c	18.3063 ± 0.0011 Å
α	64.293 ± 0.0008°
β	83.74 ± 0.0009°
γ	83.301 ± 0.0009°
Cell volume	4373.8 ± 0.5 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0584
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.08
Weighted residual factors for all reflections included in the refinement	0.0903
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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