Crystallography Open Database

Information card for entry 4301484

Preview

Coordinates	4301484.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H14 Br Cl4 N O2 Os
Calculated formula	C19 H14 Br Cl4 N O2 Os
SMILES	[Os]123456(Cl)([n]7c(cccc7C(=O)O1)Br)[cH]1[cH]2[cH]3[cH]4[cH]5[c]61c1ccccc1.C(Cl)(Cl)Cl
Title of publication	Organometallic Osmium(II) Arene Anticancer Complexes Containing Picolinate Derivatives
Authors of publication	Sabine H. van Rijt; Anna F. A. Peacock; Russell D. L. Johnstone; Simon Parsons; Peter J. Sadler
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	1753 - 1762
a	6.8555 ± 0.0008 Å
b	11.0638 ± 0.0011 Å
c	13.9209 ± 0.0019 Å
α	99.783 ± 0.007°
β	98.387 ± 0.008°
γ	91.757 ± 0.007°
Cell volume	1027.7 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0568
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.0798
Weighted residual factors for all reflections included in the refinement	0.0868
Goodness-of-fit parameter for all reflections included in the refinement	0.997
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
179052 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/14.	4301484.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4301484.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4301484.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4301484.cif