Crystallography Open Database

Information card for entry 7238060

Preview

Coordinates	7238060.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H25 Cl4 N3 Ru S
Calculated formula	C17 H25 Cl4 N3 Ru S
Title of publication	Anticancer and antimicrobial properties of novel η6-p-cymene ruthenium(ii) complexes containing a N,S-type ligand, their structural and theoretical characterization
Authors of publication	Namiecińska, Ewelina; Sadowska, Beata; Więckowska-Szakiel, Marzena; Dołęga, Anna; Pasternak, Beata; Grazul, Magdalena; Budzisz, Elzbieta
Journal of publication	RSC Advances
Year of publication	2019
Journal volume	9
Journal issue	66
Pages of publication	38629
a	13.077 ± 0.007 Å
b	14.235 ± 0.006 Å
c	23.698 ± 0.01 Å
α	90°
β	90°
γ	90°
Cell volume	4411 ± 4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
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	0.1343
Residual factor for significantly intense reflections	0.0816
Weighted residual factors for significantly intense reflections	0.1567
Weighted residual factors for all reflections included in the refinement	0.1763
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation probe	x-ray
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
243811 (current)	2019-11-28	cif/ Adding structures of 7238060, 7238061, 7238062, 7238063 via cif-deposit CGI script.	7238060.cif