Crystallography Open Database

Information card for entry 4119269

4119268 << 4119269 >> 4119270

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Coordinates	4119269.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H58 B2 F8 N10 O8 P2 Ru
Calculated formula	C52 H58 B2 F8 N10 O8 P2 Ru
Title of publication	Stabilization of Ruthenium Sensitizers to TiO2 Surfaces through Cooperative Anchoring Groups
Authors of publication	Douglas G. Brown; Phil A. Schauer; Javier Borau-Garcia; Brandon R. Fancy; Curtis P. Berlinguette
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	1692 - 1695
a	17.6552 ± 0.0004 Å
b	16.7076 ± 0.0006 Å
c	21.9443 ± 0.0002 Å
α	90°
β	107.569 ± 0.002°
γ	90°
Cell volume	6171.1 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
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	0.0886
Residual factor for significantly intense reflections	0.0789
Weighted residual factors for significantly intense reflections	0.2094
Weighted residual factors for all reflections included in the refinement	0.2189
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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