Crystallography Open Database

Information card for entry 4305230

Preview

Coordinates	4305230.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H42 Cl2 N5 O5 P Ru
Calculated formula	C40 H42 Cl2 N5 O5 P Ru
Title of publication	Synthesis, Structure, and Reactivity of Ruthenium Carboxylato and 2-Oxocarboxylato Complexes Bearing the Bis(3,5-dimethylpyrazol-1-yl)acetato Ligand
Authors of publication	Stefan Tampier; Rainer Müller; Andrea Thorn; Eike Hübner; Nicolai Burzlaff
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	9624 - 9641
a	10.403 ± 0.014 Å
b	14.176 ± 0.01 Å
c	14.692 ± 0.019 Å
α	87.39 ± 0.1°
β	73.93 ± 0.13°
γ	74.72 ± 0.09°
Cell volume	2008 ± 4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 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	0.0688
Residual factor for significantly intense reflections	0.0469
Weighted residual factors for significantly intense reflections	0.1076
Weighted residual factors for all reflections included in the refinement	0.1169
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
179090 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/52.	4305230.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4305230.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4305230.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	4305230.cif