Crystallography Open Database

Information card for entry 4071185

Preview

Coordinates	4071185.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H51 Cl6 F6 N4 O P Ru
Calculated formula	C40 H51 Cl6 F6 N4 O P Ru
SMILES	[Ru]1(Cl)([O](c2c(C=1)cc(cc2)CCC[n]1ccn(c1)C)C(C)C)(Cl)=C1N(C=CN1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C.ClCCl.[P](F)(F)(F)(F)(F)[F-].C(Cl)Cl
Title of publication	Ionic Liquid Anchored “Boomerang” Catalysts Bearing Saturated and Unsaturated NHCs: Recyclability in Biphasic Media for Cross-Metathesis
Authors of publication	Clavier, Hervé; Nolan, Steven P.; Mauduit, Marc
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	10
Pages of publication	2287
a	23.998 ± 0.002 Å
b	10.1734 ± 0.001 Å
c	19.0161 ± 0.0019 Å
α	90°
β	95.455 ± 0.002°
γ	90°
Cell volume	4621.6 ± 0.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0782
Residual factor for significantly intense reflections	0.0488
Weighted residual factors for significantly intense reflections	0.1245
Weighted residual factors for all reflections included in the refinement	0.1422
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
178600 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/11.	4071185.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071185.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071185.cif
43097	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4071185 via cif-deposit CGI script.	4071185.cif