Crystallography Open Database

Information card for entry 7051059

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Coordinates	7051059.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H46 Cl2 N10 O12 Ru
Calculated formula	C47 H34 Cl2 N9 O12 Ru
Title of publication	New hybrid ditopic ligands containing fused phenanthroline and crown ether units
Authors of publication	Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.
Journal of publication	New Journal of Chemistry
Year of publication	2001
Journal volume	25
Journal issue	2
Pages of publication	185
a	11.83 ± 0.004 Å
b	13.271 ± 0.005 Å
c	17.791 ± 0.006 Å
α	97.664 ± 0.006°
β	92.213 ± 0.006°
γ	115.897 ± 0.006°
Cell volume	2475.4 ± 1.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1009
Residual factor for significantly intense reflections	0.0525
Weighted residual factors for significantly intense reflections	0.1149
Weighted residual factors for all reflections included in the refinement	0.1252
Goodness-of-fit parameter for all reflections included in the refinement	0.894
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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