Crystallography Open Database

Information card for entry 4327798

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Coordinates	4327798.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H33 Cl F12 N10 P2 Ru2
Calculated formula	C44 H33 Cl F12 N10 P2 Ru2
Title of publication	Synthesis, Structure, and Electronic Properties of RuN6 Dinuclear Ru-Hbpp Complexes
Authors of publication	Stephan Roeser; Mehmed Z. Ertem; Clyde Cady; Rainer Lomoth; Jordi Benet-Buchholz; Leif Hammarström; Biprajit Sarkar; Wolfgang Kaim; Christopher J. Cramer; Antoni Llobet
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	320 - 327
a	21.2053 ± 0.0008 Å
b	19.3054 ± 0.0008 Å
c	11.9311 ± 0.0004 Å
α	90°
β	112.614 ± 0.002°
γ	90°
Cell volume	4508.8 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1095
Residual factor for significantly intense reflections	0.072
Weighted residual factors for significantly intense reflections	0.1737
Weighted residual factors for all reflections included in the refinement	0.2065
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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