Crystallography Open Database

Information card for entry 4067289

Preview

Coordinates	4067289.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H55 B Cl2 F4 Fe P2 Ru
Calculated formula	C64 H55 B Cl2 F4 Fe P2 Ru
Title of publication	Carbon−Carbon Bond Formation Involving a Vinylidene Ligand and Ferrocenyl Substituent in Cationic Ruthenium Complexes
Authors of publication	Chang, Li-Han; Yeh, Cheng-Wei; Ma, Hao-Wei; Liu, Shu-Yu; Lin, Ying-Chih; Wang, Yu; Liu, Yi-Hong
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	5
Pages of publication	1092
a	12.825 ± 0.0003 Å
b	14.8835 ± 0.0004 Å
c	18.0187 ± 0.0004 Å
α	88.34 ± 0.002°
β	72.265 ± 0.002°
γ	64.554 ± 0.002°
Cell volume	2937.33 ± 0.14 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0933
Residual factor for significantly intense reflections	0.0575
Weighted residual factors for significantly intense reflections	0.1738
Weighted residual factors for all reflections included in the refinement	0.1872
Goodness-of-fit parameter for all reflections included in the refinement	1
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
178563 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/72.	4067289.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4067289.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4067289.cif
34149	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4067289 via cif-deposit CGI script.	4067289.cif