Crystallography Open Database

Information card for entry 4074608

Preview

Coordinates	4074608.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26.5 H41 Cl2 F6 N P2 Ru
Calculated formula	C26.5 H41 Cl2 F6 N P2 Ru
Title of publication	Diastereoselective Synthesis of Arene Ruthenium(II) Complexes Containing Chiral Phosphetane-Based Tethers†,1
Authors of publication	Pinto, Patrícia; Götz, Andreas W.; Marconi, Guido; Hess, Bernd A.; Marinetti, Angela; Heinemann, Frank W.; Zenneck, Ulrich
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	10
Pages of publication	2607
a	19.012 ± 0.002 Å
b	10.631 ± 0.001 Å
c	31.003 ± 0.003 Å
α	90°
β	97.201 ± 0.008°
γ	90°
Cell volume	6216.8 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0674
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for significantly intense reflections	0.0792
Weighted residual factors for all reflections included in the refinement	0.0856
Goodness-of-fit parameter for all reflections included in the refinement	0.937
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4074608.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074608.cif
48608	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4074603, 4074604, 4074605, 4074606, 4074607, 4074608 via cif-deposit CGI script.	4074608.cif