Crystallography Open Database

Information card for entry 7052414

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Coordinates	7052414.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H54 O2 P2 Ru
Calculated formula	C30 H54 O2 P2 Ru
SMILES	[RuH2]1(Oc2ccccc2O1)([P](C(C)C)(C(C)C)C(C)C)[P](C(C)C)(C(C)C)C(C)C.c1ccccc1
Title of publication	New d4 dihydrides of Ru(iv) and Os(iv) with ?-donor ligands: M(H)2(chelate)(PiPr3)2 with chelate =ortho-XYC6H4 with X, Y = O, NR; R = H or CH3
Authors of publication	Ferrando-Miguel, German; Wu, Peng; Huffman, John C.; Caulton, Kenneth G.
Journal of publication	New Journal of Chemistry
Year of publication	2005
Journal volume	29
Journal issue	1
Pages of publication	193
a	11.224 ± 0.002 Å
b	11.907 ± 0.002 Å
c	12.51 ± 0.002 Å
α	77.529 ± 0.005°
β	89.453 ± 0.005°
γ	76.548 ± 0.005°
Cell volume	1586.2 ± 0.5 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for all reflections included in the refinement	0.0346
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7052414.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7052414.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7052414.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7052414.cif