Crystallography Open Database

Information card for entry 7020323

7020322 << 7020323 >> 7020324

Preview

Coordinates	7020323.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H20 Cl F6 N2 P Ru S3
Calculated formula	C16 H20 Cl F6 N2 P Ru S3
Title of publication	Factors that influence the antiproliferative activity of half sandwich Ru(II)-[9]aneS3 coordination compounds: activation kinetics and interaction with guanine derivatives.
Authors of publication	Rilak, Ana; Bratsos, Ioannis; Zangrando, Ennio; Kljun, Jakob; Turel, Iztok; Bugarčić, Živadin D; Alessio, Enzo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	38
Pages of publication	11608 - 11618
a	16.62 ± 0.0014 Å
b	9.613 ± 0.0009 Å
c	14.69 ± 0.0011 Å
α	90°
β	111.888 ± 0.009°
γ	90°
Cell volume	2177.8 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0451
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.0986
Weighted residual factors for all reflections included in the refinement	0.1016
Goodness-of-fit parameter for all reflections included in the refinement	0.992
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
179907 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/03.	7020323.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020323.cif
71568	2013-01-20	cif/ Adding structures of 7020323, 7020324, 7020325 via cif-deposit CGI script.	7020323.cif