Crystallography Open Database

Information card for entry 7034089

Preview

Coordinates	7034089.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H35 Cl F6 N3 P Ru
Calculated formula	C26 H35 Cl F6 N3 P Ru
Title of publication	A hypoxia efficient imidazole-based Ru(ii) arene anticancer agent resistant to deactivation by glutathione.
Authors of publication	Purkait, Kallol; Karmakar, Subhendu; Bhattacharyya, Sudipta; Chatterjee, Saptarshi; Dey, Suman Kr; Mukherjee, Arindam
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	13
Pages of publication	5969 - 5973
a	17.37 ± 0.002 Å
b	10.0067 ± 0.0012 Å
c	17.554 ± 0.002 Å
α	90°
β	110.743 ± 0.002°
γ	90°
Cell volume	2853.4 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0574
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for significantly intense reflections	0.104
Weighted residual factors for all reflections included in the refinement	0.1144
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180046 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/40.	7034089.cif
134946	2015-04-06	cif/ Updating files of 7034089 Original log message: Adding full bibliography for 7034089.cif.	7034089.cif
132041	2015-02-19	cif/ Adding structures of 7034089 via cif-deposit CGI script.	7034089.cif