Crystallography Open Database

Information card for entry 4117507

Preview

Coordinates	4117507.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H58 P4 Ru
Calculated formula	C28 H58 P4 Ru
Title of publication	Selective Photochemistry at Stereogenic Metal and Ligand Centers of cis-[Ru(diphosphine)2(H)2]: Preparative, NMR, Solid State, and Laser Flash Studies
Authors of publication	Marius V. Câmpian; Robin N. Perutz; Barbara Procacci; Robert J. Thatcher; Olga Torres; Adrian C. Whitwood
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	3480 - 3497
a	10.5462 ± 0.0003 Å
b	10.5462 ± 0.0003 Å
c	24.2854 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	2339.2 ± 0.18 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	4
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Residual factor for all reflections	0.0293
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.0583
Weighted residual factors for all reflections included in the refinement	0.0595
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
178946 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/75.	4117507.cif
74607	2013-03-01	cif/ Adding structures of 4117507 via cif-deposit CGI script.	4117507.cif