Crystallography Open Database

Information card for entry 4335861

Preview

Coordinates	4335861.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H23 Cl F6 N6 O0.5 P Ru
Calculated formula	C18 H23 Cl F6 N6 O0.5 P Ru
Title of publication	Anticancer Activity and DNA Binding of a Bifunctional Ru(II) Arene Aqua-Complex with the 2,4-Diamino-6-(2-pyridyl)-1,3,5-triazine Ligand
Authors of publication	Natalia Busto; Jesús Valladolid; Marta Martínez-Alonso; Héctor J. Lozano; Félix A. Jalón; Blanca R. Manzano; A. M. Rodríguez; M. Carmen Carrión; Tarita Biver; José M. Leal; Gustavo Espino; Begoña García
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	9962 - 9974
a	8.92 ± 0.0018 Å
b	11.003 ± 0.002 Å
c	12.044 ± 0.002 Å
α	92.951 ± 0.003°
β	94.387 ± 0.003°
γ	96.803 ± 0.003°
Cell volume	1168.1 ± 0.4 Å³
Cell temperature	290 ± 2 K
Ambient diffraction temperature	290 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0974
Residual factor for significantly intense reflections	0.0772
Weighted residual factors for significantly intense reflections	0.1438
Weighted residual factors for all reflections included in the refinement	0.152
Goodness-of-fit parameter for all reflections included in the refinement	1.159
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4335861.cif
101814	2014-02-18	cif/ Adding structures of 4335861 via cif-deposit CGI script.	4335861.cif