Crystallography Open Database

Information card for entry 7115166

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Coordinates	7115166.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H49 F12 N6 O3 P2 Ru
Calculated formula	C57 H38 F12 N6 O3 P2 Ru
Title of publication	A photochromic system based on photochemical or thermal chelate exchange on Ru(phen)2L2+ (L = diimine or dinitrile ligand)
Authors of publication	Baranoff, Etienne; Collin, Jean-Paul; Furusho, Yoshio; Laemmel, Anne-Chantal; Sauvage, Jean-Pierre
Journal of publication	Chemical Communications
Year of publication	2000
Journal issue	19
Pages of publication	1935
a	17.974 ± 0.0006 Å
b	21.189 ± 0.0009 Å
c	29.793 ± 0.001 Å
α	90°
β	90 ± 0.01°
γ	90°
Cell volume	11346.7 ± 0.7 Å³
Cell temperature	294 K
Ambient diffraction temperature	294 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.187
Residual factor for significantly intense reflections	0.066
Weighted residual factors for all reflections	0.848
Weighted residual factors for all reflections included in the refinement	0.095
Goodness-of-fit parameter for all reflections	9.82
Goodness-of-fit parameter for all reflections included in the refinement	1.553
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	Mo-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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