Crystallography Open Database

Information card for entry 1564051

Preview

Coordinates	1564051.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56.66 H65.32 Cl1.32 O16 P2 Ru2 Si2
Calculated formula	C56.66 H65.32 Cl1.32 O16 P2 Ru2 Si2
Title of publication	Encapsulating ruthenium in silica using a single source precursor: Differing outcomes for a cycloaddition reaction
Authors of publication	Barik, Chandan Kr; Ganguly, Rakesh; Garcia, Felipe; Leong, Weng Kee
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	512
Pages of publication	119833
a	12.6618 ± 0.0004 Å
b	13.7592 ± 0.0004 Å
c	20.8909 ± 0.0006 Å
α	99.037 ± 0.0016°
β	98.5968 ± 0.0017°
γ	117.376 ± 0.0014°
Cell volume	3088.14 ± 0.17 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0688
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0937
Weighted residual factors for all reflections included in the refinement	0.1091
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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