Crystallography Open Database

Information card for entry 7020814

7020813 << 7020814 >> 7020815

Preview

Coordinates	7020814.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H42 Cl4 P4 Ru
Calculated formula	C51 H42 Cl4 P4 Ru
Title of publication	Novel phospholyl(diphenylphosphino)methane-ruthenium complexes: unexpected non-assisted cis to trans isomerization of [RuCl2(κ(2)-P-P')2].
Authors of publication	Nguyen, Duc Hanh; Daran, Jean-Claude; Mallet-Ladeira, Sonia; Davin, Thomas; Maron, Laurent; Urrutigoïty, Martine; Kalck, Philippe; Gouygou, Maryse
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	1
Pages of publication	75 - 81
a	25.8002 ± 0.0014 Å
b	25.8002 ± 0.0014 Å
c	35.4669 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	23609 ± 2 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1086
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1351
Weighted residual factors for all reflections included in the refinement	0.1492
Goodness-of-fit parameter for all reflections included in the refinement	0.984
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
179913 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/08.	7020814.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020814.cif
73676	2013-02-21	cif/ Adding structures of 7020814, 7020815 via cif-deposit CGI script.	7020814.cif