Crystallography Open Database

Information card for entry 4070166

Preview

Coordinates	4070166.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H38 B2 F4 N7 Os P
Calculated formula	C25 H38 B2 F4 N7 Os P
Title of publication	Olefin−Alkylidene Equilibrium of 2-Vinylpyridine in Osmium- and Ruthenium-Hydrido-Tris(pyrazolyl)borate and Osmium-Cyclopentadienyl Complexes
Authors of publication	Castro-Rodrigo, Ruth; Esteruelas, Miguel A.; Fuertes, Sara; López, Ana M.; Mozo, Silvia; Oñate, Enrique
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	20
Pages of publication	5941
a	14.314 ± 0.002 Å
b	14.844 ± 0.002 Å
c	27.886 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5925.1 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0903
Residual factor for significantly intense reflections	0.0552
Weighted residual factors for significantly intense reflections	0.1014
Weighted residual factors for all reflections included in the refinement	0.1124
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
178590 (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 4/07/01.	4070166.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4070166.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070166.cif
40615	2012-03-08	../uploads/cif-deposit/cod/cif Adding structures of 4070166, 4070167, 4070168 via cif-deposit CGI script.	4070166.cif