Crystallography Open Database

Information card for entry 4318860

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Structure parameters

Formula	C32 H25 F12 N9 P2 Ru
Calculated formula	C32 H25 F12 N9 P2 Ru
Title of publication	Trans Ruthenium(II) Complexes with NH-Bridged Tetradentate Symmetric and Asymmetric Polypyridyl Ligands
Authors of publication	Javier Concepción; Oliver Just; Ana María Leiva; Barbara Loeb; William S. Rees
Journal of publication	Inorganic Chemistry
Year of publication	2002
Journal volume	41
Pages of publication	5937 - 5939
a	8.1987 ± 0.0015 Å
b	9.2888 ± 0.0017 Å
c	12.811 ± 0.002 Å
α	110.895 ± 0.003°
β	93.645 ± 0.003°
γ	94.311 ± 0.003°
Cell volume	904.6 ± 0.3 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.051
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1041
Weighted residual factors for all reflections included in the refinement	0.1082
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
301837 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/31/ Each referenced PubChem compound corresponds to the full crystal structure.	4318860.cif
179268	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/88.	4318860.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4318860.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4318860.cif
15587	2011-03-16	../uploads/cif-deposit/cod/cif Adding structures of 4318860 via cif-deposit CGI script.	4318860.cif