Crystallography Open Database

Information card for entry 4349915

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Coordinates	4349915.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H40 F6 N3 O4 P3 Ru
Calculated formula	C45 H40 F6 N3 O4 P3 Ru
Title of publication	Esterification of the free carboxylic group from the lutidinic acid ligand as a tool to improve the cytotoxicity of Ru(ii) complexes
Authors of publication	Honorato, João; Colina-Vegas, Legna; Correa, Rodrigo S.; Guedes, Adriana P. M.; Miyata, Marcelo; Pavan, Fernando R.; Ellena, Javier; Batista, Alzir A.
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2019
Journal volume	6
Journal issue	2
Pages of publication	376
a	40.71 ± 0.02 Å
b	15.001 ± 0.009 Å
c	14.658 ± 0.009 Å
α	90°
β	95.496 ± 0.007°
γ	90°
Cell volume	8910 ± 9 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 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	0.0654
Residual factor for significantly intense reflections	0.0495
Weighted residual factors for significantly intense reflections	0.1134
Weighted residual factors for all reflections included in the refinement	0.123
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
236943 (current)	2019-11-24	cif/ Adding structures of 4349915, 4349916 via cif-deposit CGI script.	4349915.cif