Crystallography Open Database

Information card for entry 7002353

Preview

Coordinates	7002353.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H40 F6 N2 O10 Ru2 S2
Calculated formula	C36 H40 F6 N2 O10 Ru2 S2
SMILES	c1(ccccc1)C1N[O]2[Ru]345678([c]9([cH]3[cH]4[c]5([cH]6[cH]79)C)C(C)C)[O]=C(c3ccccc3)N[O]8[Ru]345672([c]2([cH]3[cH]4[c]5([cH]6[cH]72)C)C(C)C)[O]=1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]
Title of publication	Novel half-sandwich Ru(II)-hydroxamate complexes: synthesis, characterization and equilibrium study in aqueous solution
Authors of publication	Buglyó, Péter; Farkas, Etelka
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	38
Pages of publication	8063 - 8070
a	11.4868 ± 0.001 Å
b	16.8356 ± 0.001 Å
c	21.3938 ± 0.001 Å
α	90°
β	92.528 ± 0.01°
γ	90°
Cell volume	4133.3 ± 0.5 Å³
Cell temperature	293 ± 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 significantly intense reflections	0.0744
Weighted residual factors for all reflections included in the refinement	0.1419
Goodness-of-fit parameter for all reflections included in the refinement	1.142
Diffraction radiation probe	x-ray
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
179721 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/23.	7002353.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002353.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002353.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002353.cif