Crystallography Open Database

Information card for entry 4071423

Preview

Coordinates	4071423.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H68 Lu O4 S3
Calculated formula	C45 H68 Lu O4 S3
Title of publication	Rare-Earth Metal Alkyl and Hydrido Complexes Containing a Thioether-Functionalized Bis(phenolato) Ligand: Efficient Catalysts for Olefin Hydrosilylation
Authors of publication	Konkol, Marcin; Kondracka, Malgorzata; Voth, Peter; Spaniol, Thomas P.; Okuda, Jun
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	15
Pages of publication	3774
a	13.2096 ± 0.0013 Å
b	26.185 ± 0.003 Å
c	27.025 ± 0.003 Å
α	90°
β	96.358 ± 0.002°
γ	90°
Cell volume	9290.3 ± 1.7 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1031
Residual factor for significantly intense reflections	0.0762
Weighted residual factors for significantly intense reflections	0.1516
Weighted residual factors for all reflections included in the refinement	0.1623
Goodness-of-fit parameter for all reflections included in the refinement	1.161
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
178603 (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 4/07/14.	4071423.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071423.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071423.cif
43831	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071421, 4071422, 4071423 via cif-deposit CGI script.	4071423.cif